data_2l1x_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 2l1x _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 ' 18' ' ' ASN . . . . . 0.774 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--O 1.22 -0.493 0 N-CA-C 112.194 0.442 . . . . 2.85 112.194 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.6 t -59.9 -18.9 48.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.007 0.432 . . . . 5.67 110.214 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.434 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.9 ptp -85.64 -24.62 27.01 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.933 -0.576 . . . . 6.02 109.569 176.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.66 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 9.5 mm-40 -75.67 -52.66 10.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.178 -0.919 . . . . 4.31 109.74 176.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.815 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.8 mpt_? -48.33 -64.78 0.7 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.127 -0.942 . . . . 5.34 111.808 -174.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.539 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 15.9 m -53.05 -18.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.902 0.751 . . . . 5.53 112.138 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.52 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 16.8 mm-40 -89.07 -47.97 7.73 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.218 0.532 . . . . 5.18 110.335 177.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.815 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 30.6 p-90 -71.59 -15.53 62.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 118.284 -1.366 . . . . 4.35 112.675 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.3 mt -46.75 -39.52 11.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 120.228 -0.589 . . . . 4.82 110.493 173.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.52 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -92.66 -9.28 41.45 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.37 -0.832 . . . . 6.77 111.308 -167.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.742 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 62.2 pttt -115.25 7.54 15.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.093 -0.503 . . . . 5.19 110.439 173.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.435 ' HD3' ' O ' ' A' ' 28' ' ' LYS . 33.3 mmtp -136.1 -37.54 0.72 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.891 1.071 . . . . 6.34 113.891 -178.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.809 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -48.76 -49.05 40.27 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 122.033 0.92 . . . . 5.5 109.696 -172.472 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.809 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -156.99 17.94 0.3 Allowed 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.167 -2.16 . . . . 5.4 105.167 163.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.552 ' HB2' ' C ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.508 -0.637 0 CA-C-N 111.291 -2.686 . . . . 4.65 112.57 -166.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.768 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 11.3 m120 . . . . . 0 C--O 1.222 -0.365 0 N-CA-C 112.948 0.721 . . . . 2.85 112.948 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.517 ' HA ' ' CD ' ' A' ' 22' ' ' ARG . 74.4 m -71.44 2.11 5.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.817 0.341 . . . . 5.67 111.539 178.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.29 -7.3 26.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.226 -1.027 . . . . 6.02 108.226 171.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 48.6 mm-40 -96.43 -46.66 6.29 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.976 -1.465 . . . . 4.31 109.22 173.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.8 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.6 mpt_? -46.47 -65.75 0.51 Allowed 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 115.322 -0.853 . . . . 5.34 111.754 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.917 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -57.41 -13.37 2.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 O-C-N 123.443 0.464 . . . . 5.53 111.809 -174.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.5 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 7.3 mm-40 -92.45 -33.34 14.56 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.382 0.611 . . . . 5.18 110.14 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.903 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 33.6 p-90 -83.99 -11.15 57.24 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 118.126 -1.43 . . . . 4.35 111.809 172.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.917 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.5 mt -62.24 -6.15 2.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.154 0.427 . . . . 4.82 112.154 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.5 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -110.01 -42.33 4.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.347 -0.388 . . . . 6.77 110.803 176.206 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.903 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 60.8 pttt -80.96 -21.27 40.51 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 111.758 0.281 . . . . 5.19 111.758 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.438 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 11.7 mmpt? -101.23 -23.79 14.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.843 0.354 . . . . 6.34 110.665 176.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.977 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 38.4 tp -52.13 -59.53 4.27 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.492 -0.776 . . . . 5.5 111.315 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.977 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -164.09 22.23 0.07 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.589 -1.187 . . . . 5.4 108.728 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.653 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 3.6 p30 . . . . . 0 N--CA 1.468 0.426 0 O-C-N 125.305 1.628 . . . . 4.65 115.274 -172.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.689 ' HB3' ' HG3' ' A' ' 21' ' ' GLU . 10.9 m120 . . . . . 0 N--CA 1.439 -1.023 0 N-CA-C 108.623 -0.88 . . . . 2.85 108.623 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.7 p -64.03 -5.83 5.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.929 -1.032 . . . . 5.67 111.63 -175.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -90.82 -28.64 18.06 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.048 -0.723 . . . . 6.02 109.048 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.689 ' HG3' ' HB3' ' A' ' 18' ' ' ASN . 30.3 mt-10 -71.02 -56.4 6.23 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.597 -1.183 . . . . 4.31 109.133 171.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.818 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 1.4 mmt180 -46.6 -69.63 0.12 Allowed 'General case' 0 CA--C 1.508 -0.671 0 CA-C-N 112.786 -2.006 . . . . 5.34 113.165 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.645 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -55.97 -15.19 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 124.091 0.869 . . . . 5.53 112.221 -168.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 11.5 mt-10 -89.74 -45.55 9.22 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.072 0.463 . . . . 5.18 110.123 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.825 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.2 p-90 -74.6 -17.11 60.76 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 118.612 -1.235 . . . . 4.35 112.391 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.659 ' O ' ' HB3' ' A' ' 30' ' ' LEU . 8.7 mt -47.68 -30.74 4.01 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.233 0.539 . . . . 4.82 111.244 175.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.635 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -99.37 -33.21 10.8 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.534 -0.757 . . . . 6.77 111.469 -171.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.825 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 58.9 pttt -88.08 -0.8 57.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.942 0.401 . . . . 5.19 110.762 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 31.6 mmmt -116.96 -28.92 6.14 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.165 0.431 . . . . 6.34 112.165 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.909 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -69.27 -35.5 76.14 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-O 121.437 0.637 . . . . 5.5 110.328 -173.779 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.909 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -158.73 16.4 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.013 -0.994 . . . . 5.4 109.303 175.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.54 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 4.7 p-10 . . . . . 0 N--CA 1.472 0.64 0 O-C-N 125.41 1.694 . . . . 4.65 112.626 -167.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.616 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 8.1 m120 . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 120.757 0.313 . . . . 2.85 110.36 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.477 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.3 t -67.87 -5.5 17.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.403 -0.362 . . . . 5.67 110.31 -178.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.3 ptm -99.94 -16.97 17.79 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 122.309 1.052 . . . . 6.02 108.511 178.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 58.9 mt-10 -84.69 -59.51 2.34 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.184 -1.825 . . . . 4.31 110.009 175.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.804 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 3.5 mpt_? -48.31 -62.65 1.38 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 115.122 -0.945 . . . . 5.34 112.521 -176.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.721 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.6 m -60.67 -6.94 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 123.783 0.677 . . . . 5.53 112.471 -166.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -94.73 -41.87 9.04 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.35 -0.611 . . . . 5.18 109.35 175.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.804 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 40.6 p-90 -80.78 -16.71 53.07 Favored 'General case' 0 CA--C 1.504 -0.819 0 C-N-CA 118.935 -1.106 . . . . 4.35 112.834 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.721 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.8 mt -49.43 -31.12 9.09 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 120.87 0.366 . . . . 4.82 111.317 176.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.731 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.85 -37.55 9.39 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.036 0.446 . . . . 6.77 110.952 -170.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.741 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -84.08 1.92 41.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.179 -0.464 . . . . 5.19 111.373 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.546 ' HD2' ' O ' ' A' ' 28' ' ' LYS . 13.9 mmmm -128.28 -24.55 3.09 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 112.964 0.727 . . . . 6.34 112.964 179.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.731 HD22 ' HA ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -59.8 -36.47 76.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.039 0.923 . . . . 5.5 109.471 -175.181 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.551 HE21 ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -159.22 5.73 0.1 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.685 -1.598 . . . . 5.4 107.347 169.567 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.536 0 CA-C-N 113.32 -1.764 . . . . 4.65 111.814 -166.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.812 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 11.8 m120 . . . . . 0 N--CA 1.449 -0.516 0 CA-C-O 119.651 -0.214 . . . . 2.85 110.479 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 22.7 t 62.19 -53.91 0.14 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.007 0.817 . . . . 5.67 111.672 -174.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.415 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.7 ptp -77.75 -27.26 50.38 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 108.022 -1.103 . . . . 6.02 108.022 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.812 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 49.0 mt-10 -80.36 -46.03 16.76 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 113.418 -1.719 . . . . 4.31 110.963 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.787 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.7 OUTLIER -48.83 -63.14 1.18 Allowed 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 123.566 0.541 . . . . 5.34 111.147 179.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.73 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 30.8 m -64.22 3.62 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 115.554 -0.748 . . . . 5.53 112.376 -169.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 20' ' ' MET . 10.8 mt-10 -100.31 -45.54 5.56 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.104 -0.702 . . . . 5.18 109.104 169.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.875 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 42.7 p-90 -77.79 -18.9 55.9 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 119.494 -0.883 . . . . 4.35 112.726 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.73 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.0 mt -50.35 -28.12 7.42 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 121.126 0.488 . . . . 4.82 111.099 176.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.785 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -103.15 -42.79 5.66 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.592 -0.731 . . . . 6.77 111.0 -172.217 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.875 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.5 pttt -78.32 -5.57 52.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.577 -0.283 . . . . 5.19 111.378 -177.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -114.87 -34.33 5.15 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.6 -0.44 . . . . 6.34 112.009 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.947 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -57.64 -38.72 75.51 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.948 0.404 . . . . 5.5 110.96 -175.12 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.947 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -159.2 23.17 0.2 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.611 -0.722 . . . . 5.4 109.428 175.678 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 CA--C 1.515 -0.377 0 CA-C-N 113.906 -1.497 . . . . 4.65 112.229 -167.68 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.645 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 21.6 m120 . . . . . 0 CA--C 1.506 -0.743 0 CA-C-O 121.074 0.464 . . . . 2.85 111.47 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.9 t -61.89 -32.49 72.86 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.5 -0.773 . . . . 5.67 109.066 177.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.766 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 27.9 ptm -76.01 -45.45 34.48 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.863 -0.608 . . . . 6.02 110.085 178.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.645 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 5.9 mp0 -48.71 -57.95 5.51 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.389 0.614 . . . . 4.31 109.736 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.71 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -53.19 -64.33 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.33 -1.305 . . . . 5.34 111.945 177.541 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.847 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 10.6 p -55.01 -19.38 4.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 123.587 0.554 . . . . 5.53 111.773 -172.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.766 ' HG2' ' O ' ' A' ' 20' ' ' MET . 8.7 mm-40 -75.04 -58.73 3.1 Favored 'General case' 0 CA--C 1.504 -0.815 0 O-C-N 121.612 -0.68 . . . . 5.18 109.255 169.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.784 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 29.6 p-90 -69.27 -14.09 62.76 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 113.784 1.031 . . . . 4.35 113.784 -174.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.847 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.6 mt -49.68 -42.21 44.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.275 1.036 . . . . 4.82 108.253 170.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.627 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.3 mpt_? -99.16 22.39 10.5 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.569 -1.196 . . . . 6.77 111.493 -170.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.784 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 55.9 pttt -131.81 -21.79 2.42 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.133 -0.485 . . . . 5.19 111.017 162.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.661 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -160.62 19.32 0.14 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 115.063 1.505 . . . . 6.34 115.063 -175.206 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.969 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -62.48 -42.61 99.6 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.522 1.056 . . . . 5.5 109.334 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.969 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -163.77 102.36 0.9 Allowed 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.125 -2.176 . . . . 5.4 105.125 169.305 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 C--N 1.318 -0.789 0 CA-C-O 122.587 1.184 . . . . 4.65 111.857 -168.194 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.713 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 10.5 m120 . . . . . 0 N--CA 1.439 -0.976 0 CA-C-O 121.49 0.662 . . . . 2.85 109.832 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.3 m -69.16 -3.89 15.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.944 -1.026 . . . . 5.67 110.82 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 22.3 ptt? -95.24 -22.64 17.67 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.176 -1.046 . . . . 6.02 108.176 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -85.93 -52.66 5.58 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.394 -1.73 . . . . 4.31 109.854 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.877 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -45.04 -63.45 0.92 Allowed 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.99 -1.004 . . . . 5.34 111.82 -178.544 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.725 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.3 m -62.55 -3.34 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.877 -0.602 . . . . 5.53 112.336 -169.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 9.0 mm-40 -96.6 -44.79 6.99 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.586 0.708 . . . . 5.18 109.496 172.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.877 ' CZ2' ' HG3' ' A' ' 22' ' ' ARG . 42.6 p-90 -77.66 -18.11 57.03 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 118.853 -1.139 . . . . 4.35 112.95 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.725 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.5 mt -48.46 -33.41 9.31 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 121.072 0.463 . . . . 4.82 110.935 175.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.554 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.81 -35.82 10.0 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.433 -0.803 . . . . 6.77 111.156 -170.473 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.834 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -85.69 -7.01 59.05 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.679 -0.408 . . . . 5.19 111.651 -177.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 30.0 mmmt -118.95 -9.47 10.07 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 119.931 -0.708 . . . . 6.34 112.21 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.73 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -87.45 -36.11 17.88 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 119.94 -0.704 . . . . 5.5 110.082 -178.699 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.73 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -176.98 42.53 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.597 -0.729 . . . . 5.4 109.589 176.165 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.565 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 9.6 p-10 . . . . . 0 N--CA 1.471 0.603 0 O-C-N 125.083 1.489 . . . . 4.65 114.444 -165.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.572 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 7.1 m120 . . . . . 0 C--O 1.22 -0.483 0 N-CA-C 111.856 0.317 . . . . 2.85 111.856 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.947 ' HA ' ' HG2' ' A' ' 22' ' ' ARG . 21.3 m -74.71 -6.02 46.47 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.935 -0.478 . . . . 5.67 110.238 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.459 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 2.4 ptt? -94.55 -26.17 16.52 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.052 -1.092 . . . . 6.02 108.052 171.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 59.1 mm-40 -68.39 -47.45 67.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.636 -1.165 . . . . 4.31 109.583 172.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.947 ' HG2' ' HA ' ' A' ' 19' ' ' SER . 22.8 mmt85 -41.5 -69.74 0.13 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 114.872 -1.058 . . . . 5.34 110.976 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.629 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 12.2 m -64.2 4.08 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.234 -0.894 . . . . 5.53 112.836 -174.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 20' ' ' MET . 17.6 mt-10 -95.54 -52.22 4.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.267 -1.012 . . . . 5.18 108.267 163.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.973 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 43.9 p-90 -71.97 -22.81 61.39 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 113.491 0.923 . . . . 4.35 113.491 -175.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.629 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.4 mt -55.37 -31.39 61.74 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 119.294 -0.962 . . . . 4.82 108.514 172.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 32' ' ' ASP . 2.5 mpt_? -110.3 -7.07 14.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 113.718 1.007 . . . . 6.77 113.718 -171.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.973 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 45.6 pttt -113.38 -1.96 14.09 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 119.824 -0.751 . . . . 5.19 110.739 174.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.431 ' CG ' ' HB2' ' A' ' 25' ' ' TRP . 14.7 mmmm -124.06 -26.86 3.96 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.092 0.775 . . . . 6.34 113.092 -173.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.89 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -66.73 -42.23 86.62 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.932 0.872 . . . . 5.5 110.29 -175.093 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.89 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -172.7 21.23 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 105.723 -1.955 . . . . 5.4 105.723 175.765 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.539 ' HA ' ' O ' ' A' ' 27' ' ' ARG . 9.6 p-10 . . . . . 0 C--O 1.214 -0.779 0 CA-C-N 111.851 -2.432 . . . . 4.65 113.57 -167.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.701 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 13.2 m120 . . . . . 0 N--CA 1.447 -0.601 0 N-CA-C 109.976 -0.379 . . . . 2.85 109.976 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 p -65.38 -14.75 61.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.763 -0.653 . . . . 5.67 110.943 -177.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 4.9 ptm -91.34 -24.38 19.81 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.797 -0.638 . . . . 6.02 109.602 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.649 ' CG ' ' HB3' ' A' ' 18' ' ' ASN . 22.3 mm-40 -73.2 -52.89 12.43 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.101 -0.954 . . . . 4.31 109.642 173.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.701 ' HG2' ' O ' ' A' ' 18' ' ' ASN . 6.7 mmt180 -42.87 -68.7 0.17 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 113.699 -1.591 . . . . 5.34 111.8 -174.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.628 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 m -56.55 -13.13 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 113.037 0.755 . . . . 5.53 113.037 -171.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.99 -35.78 16.2 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.425 0.631 . . . . 5.18 109.816 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.685 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 50.7 p-90 -90.32 -8.88 49.72 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 118.927 -1.109 . . . . 4.35 113.041 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.628 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 5.5 mt -67.77 11.9 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 4.82 112.771 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.615 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -126.49 -62.52 1.14 Allowed 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.164 -1.05 . . . . 6.77 108.164 173.187 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.626 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 52.7 pttt -61.13 -25.45 67.0 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.412 -0.813 . . . . 5.19 113.19 -176.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.596 ' HB3' ' HZ2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -129.37 -17.11 3.81 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.252 0.834 . . . . 6.34 113.252 -176.961 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 1.015 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.3 OUTLIER -49.21 -39.9 31.59 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.12 0.486 . . . . 5.5 111.34 -172.138 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 1.015 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -167.66 -1.44 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.287 -0.869 . . . . 5.4 110.309 173.13 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t0 . . . . . 0 N--CA 1.462 0.132 0 CA-C-N 114.389 -1.278 . . . . 4.65 111.566 -176.487 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.755 ' O ' ' HD3' ' A' ' 22' ' ' ARG . 10.6 m120 . . . . . 0 C--O 1.222 -0.376 0 CA-C-O 120.75 0.31 . . . . 2.85 110.687 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.8 m -75.69 3.88 8.86 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.545 0.212 . . . . 5.67 111.523 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.657 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.9 ptm -99.49 -36.58 9.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 107.912 -1.144 . . . . 6.02 107.912 168.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 22.5 mm-40 -65.42 -56.48 12.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.787 -1.097 . . . . 4.31 110.23 176.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.764 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -43.0 -66.39 0.38 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.484 -1.235 . . . . 5.34 111.874 -177.138 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.692 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.1 m -61.24 -9.48 2.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 112.469 0.544 . . . . 5.53 112.469 -173.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.657 ' HG3' ' O ' ' A' ' 20' ' ' MET . 25.9 mt-10 -83.63 -55.71 4.13 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.477 -0.934 . . . . 5.18 108.477 168.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . 0.982 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 p-90 -70.09 -19.67 63.25 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 113.609 0.966 . . . . 4.35 113.609 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.692 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.2 mt -48.81 -34.21 11.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 120.119 -0.632 . . . . 4.82 109.785 173.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.46 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.5 mpt_? -101.59 -25.13 13.99 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.19 -0.913 . . . . 6.77 112.285 -171.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.982 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.1 pttt -98.48 3.33 48.23 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.814 -0.354 . . . . 5.19 111.325 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.578 ' CG ' ' HB2' ' A' ' 25' ' ' TRP . 75.0 mmtt -122.39 -31.96 3.71 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.241 0.46 . . . . 6.34 112.241 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.726 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -63.87 -36.67 84.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 121.254 0.549 . . . . 5.5 110.531 -175.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.726 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -161.69 32.03 0.13 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.127 -0.942 . . . . 5.4 108.877 170.297 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' HA ' ' C ' ' A' ' 28' ' ' LYS . 6.0 p-10 . . . . . 0 N--CA 1.47 0.541 0 CA-C-N 113.751 -1.568 . . . . 4.65 111.974 -175.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.446 ' HB3' ' HG ' ' A' ' 9' ' ' LEU . 3.9 Cg_endo . . . . . 0 N--CA 1.478 0.58 0 N-CA-C 110.8 -0.5 . . . . 7.43 110.8 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -88.79 -151.12 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 123.219 2.613 . . . . 8.55 111.98 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.478 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 17.1 m -65.43 -23.05 66.84 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.047 0.388 . . . . 8.52 112.047 -175.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.0 p -70.33 -22.68 24.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-O 121.026 0.441 . . . . 8.64 111.393 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.762 ' HB2' HD21 ' A' ' 9' ' ' LEU . 4.0 p -126.55 21.79 7.08 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.879 0.326 . . . . 4.86 111.879 -177.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.559 ' O ' ' HB2' ' A' ' 10' ' ' MET . 7.9 pt-20 -74.6 2.19 10.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.96 0.409 . . . . 6.37 110.912 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.4 mm -99.17 -57.36 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.3 0.571 . . . . 7.04 110.326 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.541 ' HG2' HD22 ' A' ' 9' ' ' LEU . 18.3 pm0 -85.69 -32.17 22.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.427 -0.806 . . . . 6.95 111.586 -175.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.762 HD21 ' HB2' ' A' ' 5' ' ' SER . 4.3 mm? -87.49 -29.57 21.28 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.685 -0.406 . . . . 6.15 110.691 177.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.732 ' SD ' ' HE3' ' A' ' 15' ' ' LYS . 67.5 mtt -109.72 104.82 13.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.834 0.35 . . . . 5.71 110.862 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -100.79 -16.11 17.41 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.395 -0.595 . . . . 8.28 109.395 175.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -58.65 -39.09 79.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.812 -1.085 . . . . 6.39 109.273 170.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.419 ' HB3' ' H ' ' A' ' 14' ' ' GLY . 27.3 mmm180 54.7 -154.65 0.27 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.341 -0.845 . . . . 6.04 111.814 172.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.419 ' H ' ' HB3' ' A' ' 13' ' ' ARG . . . 63.02 51.26 56.7 Favored Glycine 0 C--O 1.227 -0.337 0 N-CA-C 110.554 -1.018 . . . . 4.88 110.554 -174.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.732 ' HE3' ' SD ' ' A' ' 10' ' ' MET . 71.1 mmtt -101.07 -12.45 18.82 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 113.12 0.785 . . . . 8.82 113.12 -167.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.443 ' HB2' ' H ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -147.56 -80.93 0.14 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.432 -1.321 . . . . 5.31 107.432 175.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 19' ' ' SER . 13.7 tp -125.0 -45.45 1.87 Allowed 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.803 -1.09 . . . . 5.3 109.699 170.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.774 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 0.9 OUTLIER 69.25 -22.28 0.15 Allowed 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 115.383 -0.826 . . . . 2.85 112.194 174.79 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.492 ' H ' ' C ' ' A' ' 17' ' ' LEU . 8.6 t -59.9 -18.9 48.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.007 0.432 . . . . 5.67 110.214 175.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.434 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.9 ptp -85.64 -24.62 27.01 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.933 -0.576 . . . . 6.02 109.569 176.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.66 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 9.5 mm-40 -75.67 -52.66 10.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.178 -0.919 . . . . 4.31 109.74 176.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.815 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.8 mpt_? -48.33 -64.78 0.7 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.127 -0.942 . . . . 5.34 111.808 -174.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.539 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 15.9 m -53.05 -18.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.902 0.751 . . . . 5.53 112.138 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.52 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 16.8 mm-40 -89.07 -47.97 7.73 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.218 0.532 . . . . 5.18 110.335 177.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.815 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 30.6 p-90 -71.59 -15.53 62.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 118.284 -1.366 . . . . 4.35 112.675 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.3 mt -46.75 -39.52 11.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 120.228 -0.589 . . . . 4.82 110.493 173.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.52 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -92.66 -9.28 41.45 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.37 -0.832 . . . . 6.77 111.308 -167.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.742 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 62.2 pttt -115.25 7.54 15.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.093 -0.503 . . . . 5.19 110.439 173.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.435 ' HD3' ' O ' ' A' ' 28' ' ' LYS . 33.3 mmtp -136.1 -37.54 0.72 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.891 1.071 . . . . 6.34 113.891 -178.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.809 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -48.76 -49.05 40.27 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 122.033 0.92 . . . . 5.5 109.696 -172.472 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.809 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -156.99 17.94 0.3 Allowed 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.167 -2.16 . . . . 5.4 105.167 163.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.552 ' HB2' ' C ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 38.8 107.91 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.637 0 CA-C-N 111.291 -2.686 . . . . 4.65 112.57 -166.072 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.786 ' HA ' HE22 ' A' ' 31' ' ' GLN . 5.0 p -71.37 -9.24 12.6 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 CA-C-N 112.549 -2.114 . . . . 5.8 111.232 -166.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -66.59 -9.47 35.71 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.056 -0.52 . . . . 8.88 111.765 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -78.79 5.8 10.48 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.358 0.503 . . . . 4.98 112.358 -175.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.431 ' CB ' ' HD3' ' A' ' 37' ' ' PRO . 3.2 m-85 -57.17 -57.93 21.4 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 120.738 -0.385 . . . . 6.77 110.933 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.67 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 27.4 Cg_exo -63.18 -52.76 1.86 Allowed 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 121.482 1.455 . . . . 7.44 112.796 168.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.67 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 46.0 Cg_exo -64.34 38.86 0.1 Allowed 'Trans proline' 0 C--N 1.367 1.546 0 C-N-CA 123.749 2.966 . . . . 7.84 115.063 174.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.3 t70 . . . . . 0 C--O 1.245 0.838 0 CA-C-O 118.498 -0.763 . . . . 11.49 109.97 176.986 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.48 0.71 0 N-CA-C 111.283 -0.314 . . . . 7.43 111.283 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -71.95 -64.61 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.828 2.352 . . . . 8.55 112.036 177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 67.1 m -121.3 27.47 8.33 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.36 0.6 . . . . 8.52 110.337 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.8 t -79.64 -66.34 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.731 -0.668 . . . . 8.64 110.708 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.839 ' HB2' ' HB2' ' A' ' 9' ' ' LEU . 13.2 p -92.59 -15.67 26.61 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.303 -0.408 . . . . 4.86 112.035 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -66.12 16.87 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.236 0.828 . . . . 6.37 113.236 -174.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.488 ' H ' ' C ' ' A' ' 5' ' ' SER . 28.4 mm -107.66 -46.22 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 CA-C-O 120.739 0.304 . . . . 7.04 110.659 175.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.624 HE21 ' HG ' ' A' ' 9' ' ' LEU . 5.4 pm0 -113.12 -23.42 10.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.511 0.672 . . . . 6.95 109.622 -177.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.839 ' HB2' ' HB2' ' A' ' 5' ' ' SER . 54.1 mt -110.14 27.59 9.46 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.161 -0.927 . . . . 6.15 109.871 177.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 63.8 mtt -33.59 109.39 0.07 Allowed 'General case' 0 C--N 1.346 0.446 0 O-C-N 123.716 0.635 . . . . 5.71 111.342 170.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -80.22 11.93 3.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.314 0.578 . . . . 8.28 110.608 -178.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -74.1 -12.37 60.58 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.67 -0.695 . . . . 6.39 110.955 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 13' ' ' ARG . 6.6 mpt_? -65.71 -31.26 72.16 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.366 -0.379 . . . . 6.04 110.756 175.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -151.82 101.87 0.22 Allowed Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.952 -0.642 . . . . 4.88 112.034 -177.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.44 ' HB2' ' HE2' ' A' ' 15' ' ' LYS . 14.0 ptmm? -125.67 -0.08 7.45 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.066 0.46 . . . . 8.82 110.595 177.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -158.63 -133.14 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.292 -1.003 . . . . 5.31 108.292 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.449 ' C ' ' H ' ' A' ' 19' ' ' SER . 0.4 OUTLIER -72.34 -64.05 1.03 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.73 -0.47 . . . . 5.3 109.73 175.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.768 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 11.3 m120 69.32 -17.24 0.22 Allowed 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.426 -0.806 . . . . 2.85 112.948 169.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.517 ' HA ' ' CD ' ' A' ' 22' ' ' ARG . 74.4 m -71.44 2.11 5.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.817 0.341 . . . . 5.67 111.539 178.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.29 -7.3 26.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.226 -1.027 . . . . 6.02 108.226 171.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 48.6 mm-40 -96.43 -46.66 6.29 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.976 -1.465 . . . . 4.31 109.22 173.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.8 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.6 mpt_? -46.47 -65.75 0.51 Allowed 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 115.322 -0.853 . . . . 5.34 111.754 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.917 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -57.41 -13.37 2.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 O-C-N 123.443 0.464 . . . . 5.53 111.809 -174.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.5 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 7.3 mm-40 -92.45 -33.34 14.56 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.382 0.611 . . . . 5.18 110.14 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.903 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 33.6 p-90 -83.99 -11.15 57.24 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 118.126 -1.43 . . . . 4.35 111.809 172.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.917 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.5 mt -62.24 -6.15 2.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.154 0.427 . . . . 4.82 112.154 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.5 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -110.01 -42.33 4.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.347 -0.388 . . . . 6.77 110.803 176.206 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.903 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 60.8 pttt -80.96 -21.27 40.51 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 111.758 0.281 . . . . 5.19 111.758 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.438 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 11.7 mmpt? -101.23 -23.79 14.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.843 0.354 . . . . 6.34 110.665 176.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.977 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 38.4 tp -52.13 -59.53 4.27 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.492 -0.776 . . . . 5.5 111.315 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.977 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -164.09 22.23 0.07 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.589 -1.187 . . . . 5.4 108.728 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.876 ' HA ' HD22 ' A' ' 35' ' ' ASN . 3.6 p30 13.66 97.95 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 125.305 1.628 . . . . 4.65 115.274 -172.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 31' ' ' GLN . 55.4 t -139.68 -55.48 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 113.734 -1.575 . . . . 5.8 111.14 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -93.83 34.53 1.21 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.688 0.756 . . . . 8.88 109.007 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.876 HD22 ' HA ' ' A' ' 32' ' ' ASP . 0.4 OUTLIER -172.11 62.0 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.839 -1.073 . . . . 4.98 110.678 -167.721 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.546 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 36.6 m-85 -81.49 -47.28 1.07 Allowed Pre-proline 0 C--N 1.317 -0.809 0 N-CA-C 112.14 0.422 . . . . 6.77 112.14 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.546 ' HD2' ' N ' ' A' ' 36' ' ' PHE . 7.9 Cg_exo -41.64 -46.51 6.26 Favored 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 123.068 2.512 . . . . 7.44 114.937 175.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -49.51 105.01 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.28 0 C-N-CA 122.572 2.181 . . . . 7.84 113.531 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.5 t70 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.158 -0.925 . . . . 11.49 111.119 178.568 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.614 ' HB2' ' CG1' ' A' ' 4' ' ' VAL . 56.9 Cg_exo . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 119.803 -0.165 . . . . 7.43 111.902 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.512 ' HD2' ' HB3' ' A' ' 1' ' ' PRO . 75.5 Cg_exo -17.97 -78.97 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.028 1 C-N-CA 126.187 4.592 . . . . 8.55 115.181 -166.013 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.413 ' H ' ' HB2' ' A' ' 2' ' ' PRO . 3.9 t -128.49 -6.04 5.28 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.036 0.446 . . . . 8.52 110.148 178.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.614 ' CG1' ' HB2' ' A' ' 1' ' ' PRO . 12.2 p -73.0 -39.48 57.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.151 -0.477 . . . . 8.64 111.94 -177.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.654 ' HB2' ' HG ' ' A' ' 9' ' ' LEU . 32.6 p -70.07 -20.81 63.2 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 119.905 -0.718 . . . . 4.86 112.003 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -64.53 -9.86 21.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.051 0.453 . . . . 6.37 111.152 -175.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 mp -89.21 -42.91 14.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.024 -0.535 . . . . 7.04 110.599 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 8' ' ' GLN . 1.8 mp0 -89.25 -39.89 13.21 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 120.664 -0.415 . . . . 6.95 110.412 -174.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.654 ' HG ' ' HB2' ' A' ' 5' ' ' SER . 8.7 mt -74.86 -28.23 60.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.911 0.386 . . . . 6.15 110.256 -178.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 62.0 mtt -123.82 86.28 2.55 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.358 -0.383 . . . . 5.71 111.449 -177.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.488 ' C ' ' H ' ' A' ' 13' ' ' ARG . 72.5 m-70 -91.29 -5.72 54.26 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.023 -0.732 . . . . 8.28 109.023 171.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -75.46 39.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.031 -0.986 . . . . 6.39 109.957 170.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' A' ' 11' ' ' HIS . 29.2 mmm180 -46.98 -55.6 7.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.701 -1.136 . . . . 6.04 112.181 -171.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.519 ' HA3' HD22 ' A' ' 18' ' ' ASN . . . -167.59 -48.49 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.218 -0.992 . . . . 4.88 112.583 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 14' ' ' GLY . 56.0 mtpt 75.84 -39.82 0.39 Allowed 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.431 0.692 . . . . 8.82 111.533 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.403 ' H ' ' C ' ' A' ' 14' ' ' GLY . 69.0 t60 -50.29 -82.95 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.467 0.651 . . . . 5.31 111.781 -178.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 19.8 tp -152.03 82.1 1.26 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 107.794 -1.188 . . . . 5.3 107.794 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.689 ' HB3' ' HG3' ' A' ' 21' ' ' GLU . 10.9 m120 -90.79 57.66 3.62 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 108.623 -0.88 . . . . 2.85 108.623 -176.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.7 p -64.03 -5.83 5.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.929 -1.032 . . . . 5.67 111.63 -175.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -90.82 -28.64 18.06 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.048 -0.723 . . . . 6.02 109.048 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.689 ' HG3' ' HB3' ' A' ' 18' ' ' ASN . 30.3 mt-10 -71.02 -56.4 6.23 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.597 -1.183 . . . . 4.31 109.133 171.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.818 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 1.4 mmt180 -46.6 -69.63 0.12 Allowed 'General case' 0 CA--C 1.508 -0.671 0 CA-C-N 112.786 -2.006 . . . . 5.34 113.165 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.645 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -55.97 -15.19 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 124.091 0.869 . . . . 5.53 112.221 -168.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 11.5 mt-10 -89.74 -45.55 9.22 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.072 0.463 . . . . 5.18 110.123 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.825 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.2 p-90 -74.6 -17.11 60.76 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 118.612 -1.235 . . . . 4.35 112.391 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.659 ' O ' ' HB3' ' A' ' 30' ' ' LEU . 8.7 mt -47.68 -30.74 4.01 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.233 0.539 . . . . 4.82 111.244 175.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.635 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -99.37 -33.21 10.8 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.534 -0.757 . . . . 6.77 111.469 -171.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.825 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 58.9 pttt -88.08 -0.8 57.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.942 0.401 . . . . 5.19 110.762 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 31.6 mmmt -116.96 -28.92 6.14 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.165 0.431 . . . . 6.34 112.165 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.909 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -69.27 -35.5 76.14 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-O 121.437 0.637 . . . . 5.5 110.328 -173.779 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.909 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -158.73 16.4 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.013 -0.994 . . . . 5.4 109.303 175.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.54 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 4.7 p-10 40.03 115.4 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 O-C-N 125.41 1.694 . . . . 4.65 112.626 -167.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.425 ' O ' HG23 ' A' ' 33' ' ' VAL . 6.5 p -73.08 59.41 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-O 123.1 1.429 . . . . 5.8 111.695 -172.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -117.22 -14.89 10.47 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 113.597 -1.638 . . . . 8.88 107.678 169.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -118.0 143.8 46.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.211 -1.359 . . . . 4.98 109.513 175.125 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.665 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 78.4 m-85 -105.06 -52.04 0.11 Allowed Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 116.489 -0.323 . . . . 6.77 111.706 -178.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.665 ' HD3' ' HB2' ' A' ' 36' ' ' PHE . 98.6 Cg_endo -97.85 89.01 0.07 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.088 0 C-N-CA 122.643 2.229 . . . . 7.44 112.358 170.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.661 ' HD3' ' O ' ' A' ' 36' ' ' PHE . 2.3 Cg_endo -85.04 52.79 3.47 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 123.299 2.666 . . . . 7.84 111.478 -178.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.9 t70 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.793 -0.622 . . . . 11.49 110.327 -177.571 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo . . . . . 0 N--CA 1.484 0.952 0 N-CA-C 111.352 -0.288 . . . . 7.43 111.352 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -66.97 -65.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.159 1.906 . . . . 8.55 111.606 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.499 ' HA ' ' OE1' ' A' ' 6' ' ' GLU . 2.9 p -85.93 20.04 2.37 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.975 -0.557 . . . . 8.52 111.368 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 94.4 t -103.42 -55.05 6.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.044 -0.525 . . . . 8.64 109.909 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.497 ' HB2' ' HG ' ' A' ' 9' ' ' LEU . 55.5 p -87.71 -12.41 45.4 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.21 -0.45 . . . . 4.86 112.154 -176.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.499 ' OE1' ' HA ' ' A' ' 3' ' ' SER . 10.4 pt-20 -59.57 -22.36 61.63 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 120.971 0.415 . . . . 6.37 111.557 -177.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.4 mm -86.0 -36.59 10.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.086 -0.506 . . . . 7.04 111.957 -176.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.473 ' NE2' ' HA ' ' A' ' 5' ' ' SER . 0.9 OUTLIER -96.03 -41.94 8.5 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.368 -0.533 . . . . 6.95 110.465 -175.484 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.497 ' HG ' ' HB2' ' A' ' 5' ' ' SER . 12.7 mt -85.26 -23.99 27.96 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.104 -0.498 . . . . 6.15 110.117 -177.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.434 ' C ' ' H ' ' A' ' 12' ' ' ASN . 54.9 mtt 48.28 91.39 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.354 0 O-C-N 123.74 0.65 . . . . 5.71 111.746 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -71.54 6.6 1.77 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.259 0.552 . . . . 8.28 110.482 -179.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 10' ' ' MET . 35.3 p30 -87.43 10.5 17.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.507 -0.77 . . . . 6.39 111.147 175.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.41 HH21 ' CD ' ' A' ' 21' ' ' GLU . 20.5 mmm180 -51.96 133.56 32.43 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.182 -1.044 . . . . 6.04 108.182 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.34 -28.42 67.09 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.939 -0.573 . . . . 4.88 113.653 -169.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp 60.91 17.74 8.12 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.432 0.634 . . . . 8.82 110.243 -178.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.403 ' HB3' ' H ' ' A' ' 17' ' ' LEU . 18.9 t60 -82.88 -76.88 0.26 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.111 -0.949 . . . . 5.31 109.76 -176.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 19.8 tp -139.71 59.87 1.58 Allowed 'General case' 0 N--CA 1.436 -1.125 0 CA-C-N 114.901 -1.045 . . . . 5.3 108.193 176.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.616 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 8.1 m120 -79.07 23.6 0.35 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.712 -0.676 . . . . 2.85 110.36 -176.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.477 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.3 t -67.87 -5.5 17.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.403 -0.362 . . . . 5.67 110.31 -178.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.3 ptm -99.94 -16.97 17.79 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 122.309 1.052 . . . . 6.02 108.511 178.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.432 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 58.9 mt-10 -84.69 -59.51 2.34 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.184 -1.825 . . . . 4.31 110.009 175.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.804 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 3.5 mpt_? -48.31 -62.65 1.38 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 115.122 -0.945 . . . . 5.34 112.521 -176.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.721 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.6 m -60.67 -6.94 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 123.783 0.677 . . . . 5.53 112.471 -166.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -94.73 -41.87 9.04 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.35 -0.611 . . . . 5.18 109.35 175.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.804 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 40.6 p-90 -80.78 -16.71 53.07 Favored 'General case' 0 CA--C 1.504 -0.819 0 C-N-CA 118.935 -1.106 . . . . 4.35 112.834 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.721 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.8 mt -49.43 -31.12 9.09 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 120.87 0.366 . . . . 4.82 111.317 176.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.731 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.85 -37.55 9.39 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.036 0.446 . . . . 6.77 110.952 -170.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.741 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -84.08 1.92 41.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.179 -0.464 . . . . 5.19 111.373 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.546 ' HD2' ' O ' ' A' ' 28' ' ' LYS . 13.9 mmmm -128.28 -24.55 3.09 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 112.964 0.727 . . . . 6.34 112.964 179.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.731 HD22 ' HA ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -59.8 -36.47 76.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.039 0.923 . . . . 5.5 109.471 -175.181 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.551 HE21 ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -159.22 5.73 0.1 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.685 -1.598 . . . . 5.4 107.347 169.567 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER 51.36 119.36 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 113.32 -1.764 . . . . 4.65 111.814 -166.449 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.5 p -68.9 -6.23 5.74 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 CA-C-N 113.752 -1.567 . . . . 5.8 112.4 -167.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -61.63 -28.39 69.34 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 122.113 -0.367 . . . . 8.88 111.462 177.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 36' ' ' PHE . 0.4 OUTLIER -99.85 -25.43 14.35 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.491 -0.322 . . . . 4.98 111.446 -179.759 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.475 ' HB2' ' O ' ' A' ' 35' ' ' ASN . 69.3 m-85 70.31 164.0 0.14 Allowed Pre-proline 0 C--O 1.234 0.281 0 O-C-N 124.166 0.916 . . . . 6.77 110.026 -170.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.588 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 83.4 Cg_exo -44.7 -45.56 13.28 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.553 2.169 . . . . 7.44 113.838 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.588 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 86.3 Cg_exo -51.92 91.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.361 1.233 0 C-N-CA 122.735 2.29 . . . . 7.84 113.284 171.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.335 -0.841 . . . . 11.49 110.474 179.676 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo . . . . . 0 N--CA 1.482 0.841 0 N-CA-C 110.503 -0.614 . . . . 7.43 110.503 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -72.46 -71.14 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.464 0 C-N-CA 122.926 2.417 . . . . 8.55 113.304 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 p -131.26 -20.92 2.65 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.291 0.478 . . . . 8.52 112.291 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.0 p -62.47 -22.03 28.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.138 0.494 . . . . 8.64 111.169 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.918 ' HB3' HD21 ' A' ' 9' ' ' LEU . 30.4 m -92.52 3.29 55.8 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.214 -0.448 . . . . 4.86 112.16 -178.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.617 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 42.4 mt-10 -71.86 26.4 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.953 -0.299 . . . . 6.37 111.628 174.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.51 ' H ' ' C ' ' A' ' 5' ' ' SER . 29.7 mm -120.46 -59.25 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 121.444 0.64 . . . . 7.04 109.87 173.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.585 ' HG2' HD22 ' A' ' 9' ' ' LEU . 18.3 pm0 -83.86 -26.22 29.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.445 -0.798 . . . . 6.95 110.791 -177.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.918 HD21 ' HB3' ' A' ' 5' ' ' SER . 4.1 mm? -90.12 -49.88 6.32 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.52 -0.472 . . . . 6.15 110.824 175.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.627 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 1.0 OUTLIER -86.19 106.03 17.01 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 120.924 0.393 . . . . 5.71 110.893 -177.303 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -93.43 -2.89 54.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.557 0.694 . . . . 8.28 109.365 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.472 ' OD1' ' HB3' ' A' ' 10' ' ' MET . 25.3 p-10 -79.6 8.27 6.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.979 -1.009 . . . . 6.39 110.697 176.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 10' ' ' MET . 9.6 mmm180 -84.61 -41.55 16.28 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 120.984 0.421 . . . . 6.04 110.427 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.7 -128.18 1.82 Allowed Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.916 -0.659 . . . . 4.88 111.702 -176.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -136.6 126.21 25.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.332 0.11 . . . . 8.82 111.019 -178.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 70.31 -72.41 0.11 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.315 0.579 . . . . 5.31 111.951 174.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 tp -160.71 -47.67 0.05 OUTLIER 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.782 -0.822 . . . . 5.3 108.782 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.812 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 11.8 m120 64.67 -90.02 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.661 -1.154 . . . . 2.85 110.479 -178.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 22.7 t 62.19 -53.91 0.14 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.007 0.817 . . . . 5.67 111.672 -174.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.415 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.7 ptp -77.75 -27.26 50.38 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 108.022 -1.103 . . . . 6.02 108.022 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.812 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 49.0 mt-10 -80.36 -46.03 16.76 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 113.418 -1.719 . . . . 4.31 110.963 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.787 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.7 OUTLIER -48.83 -63.14 1.18 Allowed 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 123.566 0.541 . . . . 5.34 111.147 179.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.73 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 30.8 m -64.22 3.62 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 115.554 -0.748 . . . . 5.53 112.376 -169.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 20' ' ' MET . 10.8 mt-10 -100.31 -45.54 5.56 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.104 -0.702 . . . . 5.18 109.104 169.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.875 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 42.7 p-90 -77.79 -18.9 55.9 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 119.494 -0.883 . . . . 4.35 112.726 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.73 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.0 mt -50.35 -28.12 7.42 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 121.126 0.488 . . . . 4.82 111.099 176.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.785 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -103.15 -42.79 5.66 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.592 -0.731 . . . . 6.77 111.0 -172.217 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.875 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.5 pttt -78.32 -5.57 52.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.577 -0.283 . . . . 5.19 111.378 -177.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -114.87 -34.33 5.15 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.6 -0.44 . . . . 6.34 112.009 178.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.947 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -57.64 -38.72 75.51 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.948 0.404 . . . . 5.5 110.96 -175.12 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.947 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -159.2 23.17 0.2 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.611 -0.722 . . . . 5.4 109.428 175.678 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 41.04 101.61 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 113.906 -1.497 . . . . 4.65 112.229 -167.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.645 ' HA ' HE22 ' A' ' 31' ' ' GLN . 2.4 p -55.89 138.28 16.51 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 113.096 -1.866 . . . . 5.8 112.122 -173.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 33' ' ' VAL . 84.7 t60 82.47 -14.04 0.79 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.032 -1.44 . . . . 8.88 110.026 -173.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.5 m120 59.12 97.87 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.952 0.882 . . . . 4.98 111.602 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.818 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 77.7 m-85 -83.17 -57.22 0.44 Allowed Pre-proline 0 C--N 1.315 -0.897 0 CA-C-N 114.752 -1.113 . . . . 6.77 111.367 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.818 ' HD3' ' HB2' ' A' ' 36' ' ' PHE . 34.2 Cg_exo -62.84 -52.67 2.1 Favored 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 122.217 1.945 . . . . 7.44 114.184 174.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.499 ' HD3' ' HD2' ' A' ' 37' ' ' PRO . 12.5 Cg_exo -70.49 92.86 0.58 Allowed 'Trans proline' 0 C--N 1.363 1.29 0 C-N-CA 122.493 2.129 . . . . 7.84 113.405 -174.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.7 t70 . . . . . 0 C--O 1.248 0.988 0 CA-C-N 115.69 -0.686 . . . . 11.49 110.205 173.13 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 N--CA 1.482 0.848 0 N-CA-C 110.814 -0.495 . . . . 7.43 110.814 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.63 106.19 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.09 2.527 . . . . 8.55 112.553 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.0 m 60.07 7.7 1.27 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.827 -1.078 . . . . 8.52 111.97 -176.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 80.5 t -80.98 -42.38 20.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.209 0.528 . . . . 8.64 109.79 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.59 ' CB ' HD13 ' A' ' 9' ' ' LEU . 52.8 p -121.84 -26.61 4.8 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.411 -0.516 . . . . 4.86 112.025 174.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -56.64 -20.71 22.72 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.511 0.56 . . . . 6.37 112.511 -172.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 24.9 mm -113.36 -18.68 7.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 111.994 0.368 . . . . 7.04 111.994 -177.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.706 ' HA ' ' HD3' ' A' ' 13' ' ' ARG . 2.2 mp0 -107.12 -26.19 11.22 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.297 -0.561 . . . . 6.95 111.758 -171.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.59 HD13 ' CB ' ' A' ' 5' ' ' SER . 10.4 mp -88.96 -15.73 33.5 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.25 0.548 . . . . 6.15 109.882 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.414 ' C ' ' H ' ' A' ' 12' ' ' ASN . 0.3 OUTLIER -68.57 122.74 19.12 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 108.632 -0.877 . . . . 5.71 108.632 165.213 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -79.69 43.69 0.59 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.413 0.625 . . . . 8.28 110.391 -176.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 10' ' ' MET . 54.8 m-20 -113.35 15.56 19.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.891 -1.049 . . . . 6.39 108.898 -179.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.706 ' HD3' ' HA ' ' A' ' 8' ' ' GLN . 26.4 mmm180 -60.06 150.72 28.53 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.022 -0.99 . . . . 6.04 110.93 -177.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.9 -130.03 2.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.506 -0.854 . . . . 4.88 112.491 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -92.71 -64.62 1.08 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.416 0.627 . . . . 8.82 110.807 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -108.88 -54.52 2.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.37 -0.832 . . . . 5.31 109.471 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.451 ' HG ' ' H ' ' A' ' 19' ' ' SER . 1.0 OUTLIER 177.55 -46.43 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 106.601 -1.629 . . . . 5.3 106.601 -177.529 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.645 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 21.6 m120 53.81 32.86 15.74 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 113.073 -1.876 . . . . 2.85 111.47 166.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.451 ' H ' ' HG ' ' A' ' 17' ' ' LEU . 33.9 t -61.89 -32.49 72.86 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.5 -0.773 . . . . 5.67 109.066 177.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.766 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 27.9 ptm -76.01 -45.45 34.48 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.863 -0.608 . . . . 6.02 110.085 178.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.645 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 5.9 mp0 -48.71 -57.95 5.51 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.389 0.614 . . . . 4.31 109.736 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.71 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -53.19 -64.33 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.33 -1.305 . . . . 5.34 111.945 177.541 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.847 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 10.6 p -55.01 -19.38 4.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 123.587 0.554 . . . . 5.53 111.773 -172.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.766 ' HG2' ' O ' ' A' ' 20' ' ' MET . 8.7 mm-40 -75.04 -58.73 3.1 Favored 'General case' 0 CA--C 1.504 -0.815 0 O-C-N 121.612 -0.68 . . . . 5.18 109.255 169.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.784 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 29.6 p-90 -69.27 -14.09 62.76 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 113.784 1.031 . . . . 4.35 113.784 -174.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.847 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.6 mt -49.68 -42.21 44.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.275 1.036 . . . . 4.82 108.253 170.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.627 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.3 mpt_? -99.16 22.39 10.5 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.569 -1.196 . . . . 6.77 111.493 -170.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.784 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 55.9 pttt -131.81 -21.79 2.42 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.133 -0.485 . . . . 5.19 111.017 162.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.661 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -160.62 19.32 0.14 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 115.063 1.505 . . . . 6.34 115.063 -175.206 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.969 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -62.48 -42.61 99.6 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.522 1.056 . . . . 5.5 109.334 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.969 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -163.77 102.36 0.9 Allowed 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.125 -2.176 . . . . 5.4 105.125 169.305 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.793 ' HA ' ' ND2' ' A' ' 35' ' ' ASN . 4.2 p-10 -63.6 101.33 0.33 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.587 1.184 . . . . 4.65 111.857 -168.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 79.6 t -135.59 -69.14 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 113.196 -1.82 . . . . 5.8 109.646 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -100.72 -13.61 18.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.95 0.881 . . . . 8.88 109.029 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.793 ' ND2' ' HA ' ' A' ' 32' ' ' ASP . 0.6 OUTLIER -97.29 64.18 1.88 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.654 -1.157 . . . . 4.98 109.145 176.635 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.497 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.2 OUTLIER -101.8 -25.19 0.21 Allowed Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 114.041 1.126 . . . . 6.77 114.041 -174.383 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.525 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 37.0 Cg_exo -37.9 -42.53 1.39 Allowed 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.902 2.402 . . . . 7.44 115.637 175.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 33.0 Cg_exo -61.57 84.15 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 122.294 1.996 . . . . 7.84 113.047 173.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.7 t70 . . . . . 0 C--O 1.254 1.309 0 CA-C-O 118.369 -0.824 . . . . 11.49 111.476 176.172 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 0.676 0 N-CA-C 110.661 -0.553 . . . . 7.43 110.661 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.462 ' HB2' ' H ' ' A' ' 3' ' ' SER . 6.2 Cg_exo -71.68 -96.11 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.555 2.17 . . . . 8.55 111.696 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.551 ' HA ' ' HG2' ' A' ' 6' ' ' GLU . 67.5 m -78.29 1.56 21.3 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.242 0.544 . . . . 8.52 110.571 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.36 -53.97 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 115.545 -0.752 . . . . 8.64 109.931 172.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.806 ' HB3' ' HB2' ' A' ' 9' ' ' LEU . 16.0 m -141.17 19.35 2.26 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.945 0.72 . . . . 4.86 112.945 -175.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.721 ' HG3' ' H ' ' A' ' 7' ' ' ILE . 6.3 pt-20 -47.92 -67.47 0.27 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.155 0.428 . . . . 6.37 112.155 -177.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.721 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 27.4 mm -112.61 -1.08 9.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.044 0.449 . . . . 7.04 110.62 -177.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' A' ' 8' ' ' GLN . 1.0 OUTLIER -92.22 -55.89 3.26 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.634 -0.426 . . . . 6.95 111.416 -171.73 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.806 ' HB2' ' HB3' ' A' ' 5' ' ' SER . 3.6 mm? -90.4 19.14 5.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.856 0.36 . . . . 6.15 111.15 -176.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.578 ' HB2' ' HG2' ' A' ' 13' ' ' ARG . 21.0 mtt -63.02 114.24 3.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.006 -0.543 . . . . 5.71 110.885 173.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -68.96 -11.84 61.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 122.01 0.91 . . . . 8.28 108.65 170.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -65.91 -29.48 69.91 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.051 -1.431 . . . . 6.39 111.208 172.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.578 ' HG2' ' HB2' ' A' ' 10' ' ' MET . 45.2 mmm-85 -59.97 -43.14 95.27 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.844 0.683 . . . . 6.04 112.844 -171.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -148.06 153.26 25.17 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.149 -1.024 . . . . 4.88 112.495 -175.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -105.95 -59.48 1.77 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.622 0.248 . . . . 8.82 111.21 -178.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -123.85 49.03 1.79 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.205 -0.665 . . . . 5.31 109.205 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 mm? 45.13 78.26 0.06 Allowed 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 122.373 1.082 . . . . 5.3 112.182 -178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.713 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 10.5 m120 -93.09 30.48 1.62 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 113.997 -1.456 . . . . 2.85 109.832 -169.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.3 m -69.16 -3.89 15.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.944 -1.026 . . . . 5.67 110.82 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 22.3 ptt? -95.24 -22.64 17.67 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.176 -1.046 . . . . 6.02 108.176 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -85.93 -52.66 5.58 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.394 -1.73 . . . . 4.31 109.854 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.877 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -45.04 -63.45 0.92 Allowed 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.99 -1.004 . . . . 5.34 111.82 -178.544 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.725 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.3 m -62.55 -3.34 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.877 -0.602 . . . . 5.53 112.336 -169.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 9.0 mm-40 -96.6 -44.79 6.99 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.586 0.708 . . . . 5.18 109.496 172.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.877 ' CZ2' ' HG3' ' A' ' 22' ' ' ARG . 42.6 p-90 -77.66 -18.11 57.03 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 118.853 -1.139 . . . . 4.35 112.95 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.725 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.5 mt -48.46 -33.41 9.31 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 121.072 0.463 . . . . 4.82 110.935 175.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.554 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.81 -35.82 10.0 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.433 -0.803 . . . . 6.77 111.156 -170.473 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.834 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -85.69 -7.01 59.05 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.679 -0.408 . . . . 5.19 111.651 -177.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.442 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 30.0 mmmt -118.95 -9.47 10.07 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 119.931 -0.708 . . . . 6.34 112.21 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.73 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -87.45 -36.11 17.88 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 119.94 -0.704 . . . . 5.5 110.082 -178.699 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.73 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -176.98 42.53 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.597 -0.729 . . . . 5.4 109.589 176.165 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.565 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 9.6 p-10 -19.5 108.28 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 O-C-N 125.083 1.489 . . . . 4.65 114.444 -165.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 11.0 p -127.47 -40.12 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 114.08 -1.418 . . . . 5.8 111.525 -174.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -112.16 41.92 1.88 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.325 0.583 . . . . 8.88 109.728 177.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.505 ' HA ' ' HG2' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -144.01 25.81 1.56 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-N 115.471 -0.786 . . . . 4.98 109.403 -175.738 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -73.82 -48.72 6.37 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.338 -0.846 . . . . 6.77 110.769 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.613 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 48.3 Cg_exo -56.29 -49.97 13.5 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.732 1.621 . . . . 7.44 112.679 170.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.613 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 63.4 Cg_exo -46.44 123.25 6.54 Favored 'Trans proline' 0 C--N 1.366 1.471 0 C-N-CA 122.407 2.072 . . . . 7.84 112.623 169.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.8 t70 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.491 -0.766 . . . . 11.49 111.018 -175.691 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.476 0.456 0 N-CA-C 111.131 -0.373 . . . . 7.43 111.131 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -94.32 -157.79 0.05 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 123.086 2.524 . . . . 8.55 111.839 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.545 ' HA ' ' HG3' ' A' ' 6' ' ' GLU . 71.8 m -70.46 -13.34 62.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.824 0.345 . . . . 8.52 111.299 178.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 94.6 t -57.9 -44.65 86.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.028 -0.533 . . . . 8.64 111.203 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.696 ' HA ' ' NE2' ' A' ' 8' ' ' GLN . 5.8 p -90.26 -9.64 47.21 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.618 0.599 . . . . 4.86 112.618 -175.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.545 ' HG3' ' HA ' ' A' ' 3' ' ' SER . 44.0 mt-10 -58.33 -18.5 27.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.031 0.443 . . . . 6.37 110.667 175.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 45.3 mm -73.24 -62.12 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.784 -0.644 . . . . 7.04 111.306 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.696 ' NE2' ' HA ' ' A' ' 5' ' ' SER . 0.9 OUTLIER -102.27 -3.77 26.73 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.407 0.521 . . . . 6.95 112.407 -171.684 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.557 HD21 ' HB2' ' A' ' 5' ' ' SER . 4.2 mm? -102.39 -12.81 17.61 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.449 -0.575 . . . . 6.15 109.449 168.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 64.2 mtt 70.78 133.47 0.03 OUTLIER 'General case' 0 C--N 1.343 0.291 0 CA-C-N 114.778 -1.101 . . . . 5.71 112.816 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -100.9 -7.02 23.87 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.198 -0.667 . . . . 8.28 109.198 167.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -81.84 42.3 0.7 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.383 -0.826 . . . . 6.39 109.99 172.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -58.08 -24.03 56.96 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.662 -0.699 . . . . 6.04 110.802 -177.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -128.23 -90.86 0.68 Allowed Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.758 -0.937 . . . . 4.88 110.758 172.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -145.52 118.65 8.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.014 -0.736 . . . . 8.82 109.014 172.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.413 ' HD2' ' HB3' ' A' ' 17' ' ' LEU . 10.9 t60 69.87 -66.22 0.28 Allowed 'General case' 0 N--CA 1.471 0.594 0 O-C-N 123.481 0.488 . . . . 5.31 110.922 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.864 ' HG ' ' H ' ' A' ' 19' ' ' SER . 6.9 tp -165.64 -72.97 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.27 -1.011 . . . . 5.3 108.27 -177.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.572 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 7.1 m120 58.93 15.78 4.15 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.659 -0.701 . . . . 2.85 111.856 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.947 ' HA ' ' HG2' ' A' ' 22' ' ' ARG . 21.3 m -74.71 -6.02 46.47 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.935 -0.478 . . . . 5.67 110.238 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.459 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 2.4 ptt? -94.55 -26.17 16.52 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.052 -1.092 . . . . 6.02 108.052 171.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 59.1 mm-40 -68.39 -47.45 67.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.636 -1.165 . . . . 4.31 109.583 172.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.947 ' HG2' ' HA ' ' A' ' 19' ' ' SER . 22.8 mmt85 -41.5 -69.74 0.13 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 114.872 -1.058 . . . . 5.34 110.976 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.629 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 12.2 m -64.2 4.08 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.234 -0.894 . . . . 5.53 112.836 -174.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 20' ' ' MET . 17.6 mt-10 -95.54 -52.22 4.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.267 -1.012 . . . . 5.18 108.267 163.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.973 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 43.9 p-90 -71.97 -22.81 61.39 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 113.491 0.923 . . . . 4.35 113.491 -175.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.629 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.4 mt -55.37 -31.39 61.74 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 119.294 -0.962 . . . . 4.82 108.514 172.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 32' ' ' ASP . 2.5 mpt_? -110.3 -7.07 14.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 113.718 1.007 . . . . 6.77 113.718 -171.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.973 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 45.6 pttt -113.38 -1.96 14.09 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 119.824 -0.751 . . . . 5.19 110.739 174.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.431 ' CG ' ' HB2' ' A' ' 25' ' ' TRP . 14.7 mmmm -124.06 -26.86 3.96 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.092 0.775 . . . . 6.34 113.092 -173.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.89 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -66.73 -42.23 86.62 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.932 0.872 . . . . 5.5 110.29 -175.093 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.89 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -172.7 21.23 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 105.723 -1.955 . . . . 5.4 105.723 175.765 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.539 ' HA ' ' O ' ' A' ' 27' ' ' ARG . 9.6 p-10 26.84 101.42 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 111.851 -2.432 . . . . 4.65 113.57 -167.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.604 ' HA ' HE22 ' A' ' 31' ' ' GLN . 8.9 p -65.17 -3.28 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.363 -1.289 . . . . 5.8 110.811 -173.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -54.95 -31.46 60.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.113 -0.949 . . . . 8.88 110.391 167.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.49 ' HB2' ' HD2' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -102.35 138.6 39.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.491 0.663 . . . . 4.98 111.07 175.87 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.654 ' C ' ' HD3' ' A' ' 38' ' ' PRO . 39.6 m-85 -107.02 -6.92 0.11 Allowed Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 114.871 1.434 . . . . 6.77 114.871 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 36' ' ' PHE . 45.8 Cg_endo -104.14 69.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.363 1.297 0 CA-C-N 121.908 1.717 . . . . 7.44 114.168 171.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.654 ' HD3' ' C ' ' A' ' 36' ' ' PHE . 6.3 Cg_endo -87.37 74.42 2.58 Favored 'Trans proline' 0 N--CA 1.444 -1.383 0 C-N-CA 122.65 2.233 . . . . 7.84 109.89 173.013 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.2 t70 . . . . . 0 C--O 1.246 0.907 0 O-C-N 124.617 1.198 . . . . 11.49 112.915 -172.465 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.466 ' CB ' ' HB ' ' A' ' 4' ' ' VAL . 3.0 Cg_exo . . . . . 0 N--CA 1.48 0.69 0 N-CA-C 110.604 -0.575 . . . . 7.43 110.604 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.56 -60.02 0.63 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.245 2.63 . . . . 8.55 113.038 -173.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.554 ' HA ' ' OE1' ' A' ' 6' ' ' GLU . 66.5 m -95.49 11.64 32.26 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.177 0.513 . . . . 8.52 111.638 -177.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.466 ' HB ' ' CB ' ' A' ' 1' ' ' PRO . 72.3 t -102.27 -42.71 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.99 -0.55 . . . . 8.64 109.756 175.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.835 ' HB3' HD21 ' A' ' 9' ' ' LEU . 33.3 m -99.41 1.1 43.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.932 -0.576 . . . . 4.86 112.245 -177.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.554 ' OE1' ' HA ' ' A' ' 3' ' ' SER . 10.0 pt-20 -68.76 -6.11 24.61 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.108 0.48 . . . . 6.37 111.033 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.6 mm -96.05 -47.86 12.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.092 -0.504 . . . . 7.04 111.37 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.635 ' OE1' ' HA ' ' A' ' 5' ' ' SER . 5.4 mp0 -89.06 -43.4 11.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.863 0.363 . . . . 6.95 110.186 -174.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.835 HD21 ' HB3' ' A' ' 5' ' ' SER . 3.1 mm? -90.29 -20.93 22.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.049 -0.523 . . . . 6.15 111.783 -173.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 6' ' ' GLU . 64.6 mtt -106.46 135.33 48.14 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.451 -0.5 . . . . 5.71 111.123 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -96.23 -4.85 41.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.663 -0.699 . . . . 8.28 110.104 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -77.66 41.66 0.34 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.527 -0.76 . . . . 6.39 112.602 -175.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.08 -18.93 52.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.099 0.476 . . . . 6.04 110.599 178.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.514 ' HA3' HH22 ' A' ' 22' ' ' ARG . . . 174.08 170.91 37.95 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.421 -0.672 . . . . 4.88 111.421 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.503 ' HD2' ' N ' ' A' ' 15' ' ' LYS . 2.0 mptt -112.95 152.96 28.75 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.712 -0.477 . . . . 8.82 109.712 -177.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 58.0 t60 61.5 -82.8 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.58 0.55 . . . . 5.31 111.466 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.3 tp 177.16 81.84 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.442 -1.318 . . . . 5.3 107.442 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.701 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 13.2 m120 -81.66 45.63 0.9 Allowed 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.116 -0.493 . . . . 2.85 109.976 -175.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 p -65.38 -14.75 61.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.763 -0.653 . . . . 5.67 110.943 -177.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 4.9 ptm -91.34 -24.38 19.81 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.797 -0.638 . . . . 6.02 109.602 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.649 ' CG ' ' HB3' ' A' ' 18' ' ' ASN . 22.3 mm-40 -73.2 -52.89 12.43 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.101 -0.954 . . . . 4.31 109.642 173.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.701 ' HG2' ' O ' ' A' ' 18' ' ' ASN . 6.7 mmt180 -42.87 -68.7 0.17 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 113.699 -1.591 . . . . 5.34 111.8 -174.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.628 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 m -56.55 -13.13 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 113.037 0.755 . . . . 5.53 113.037 -171.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.99 -35.78 16.2 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.425 0.631 . . . . 5.18 109.816 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.685 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 50.7 p-90 -90.32 -8.88 49.72 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 118.927 -1.109 . . . . 4.35 113.041 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.628 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 5.5 mt -67.77 11.9 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 4.82 112.771 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.615 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -126.49 -62.52 1.14 Allowed 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.164 -1.05 . . . . 6.77 108.164 173.187 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.626 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 52.7 pttt -61.13 -25.45 67.0 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.412 -0.813 . . . . 5.19 113.19 -176.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.596 ' HB3' ' HZ2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -129.37 -17.11 3.81 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.252 0.834 . . . . 6.34 113.252 -176.961 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 1.015 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.3 OUTLIER -49.21 -39.9 31.59 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.12 0.486 . . . . 5.5 111.34 -172.138 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 1.015 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -167.66 -1.44 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.287 -0.869 . . . . 5.4 110.309 173.13 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.695 ' HA ' ' ND2' ' A' ' 35' ' ' ASN . 31.8 t0 60.23 138.2 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 114.389 -1.278 . . . . 4.65 111.566 -176.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.707 ' HB ' HE22 ' A' ' 31' ' ' GLN . 9.1 p -168.92 -45.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 CA-C-N 115.283 -0.871 . . . . 5.8 110.67 -171.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -132.63 29.2 4.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.81 0.814 . . . . 8.88 109.493 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.695 ' ND2' ' HA ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -133.82 24.58 3.98 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.995 -1.002 . . . . 4.98 110.078 -174.337 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 -67.01 -47.44 52.65 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 115.323 -0.853 . . . . 6.77 111.856 177.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.474 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 50.8 Cg_exo -54.87 -49.8 15.46 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 122.336 2.024 . . . . 7.44 113.782 174.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.474 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 11.5 Cg_exo -36.79 111.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.365 1.397 0 C-N-CA 123.248 2.632 . . . . 7.84 113.791 172.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.461 -0.781 . . . . 11.49 111.134 -176.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo . . . . . 0 N--CA 1.48 0.695 0 N-CA-C 110.668 -0.551 . . . . 7.43 110.668 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -66.82 -72.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.985 2.456 . . . . 8.55 112.641 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.5 m -139.93 -35.2 0.53 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 111.891 0.33 . . . . 8.52 111.891 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 76.3 t -49.98 -40.13 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.825 0.345 . . . . 8.64 111.51 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.475 ' O ' HD23 ' A' ' 9' ' ' LEU . 49.3 m -136.13 62.54 1.61 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.746 0.308 . . . . 4.86 111.11 174.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.811 ' HG3' ' H ' ' A' ' 7' ' ' ILE . 8.6 pt-20 -81.01 -74.65 0.31 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 120.734 -0.387 . . . . 6.37 110.801 172.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.811 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 29.5 mm -113.54 63.26 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.267 0.556 . . . . 7.04 110.269 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -139.99 -63.02 0.5 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.875 -0.602 . . . . 6.95 110.277 -178.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.716 HD22 ' N ' ' A' ' 9' ' ' LEU . 1.7 pt? -50.21 -30.79 12.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.342 -0.844 . . . . 6.15 112.37 175.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 65.8 mtt -75.99 75.72 2.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.981 0.42 . . . . 5.71 110.862 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -77.16 -13.86 59.88 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.666 -0.494 . . . . 8.28 109.666 175.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -65.2 -22.63 66.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.482 -0.781 . . . . 6.39 110.214 173.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 42.06 55.34 3.87 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 124.319 1.012 . . . . 6.04 113.112 172.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.59 -108.21 0.24 Allowed Glycine 0 N--CA 1.444 -0.83 0 C-N-CA 120.644 -0.789 . . . . 4.88 112.29 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -132.05 101.24 5.33 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.719 0.295 . . . . 8.82 110.411 -175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 49.98 -118.89 1.22 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.681 -0.691 . . . . 5.31 111.121 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 23.0 tp -135.17 68.18 1.47 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.55 -0.907 . . . . 5.3 108.55 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.755 ' O ' ' HD3' ' A' ' 22' ' ' ARG . 10.6 m120 -84.49 40.35 0.78 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.479 -0.782 . . . . 2.85 110.687 -178.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.8 m -75.69 3.88 8.86 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.545 0.212 . . . . 5.67 111.523 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.657 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.9 ptm -99.49 -36.58 9.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 107.912 -1.144 . . . . 6.02 107.912 168.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 22.5 mm-40 -65.42 -56.48 12.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.787 -1.097 . . . . 4.31 110.23 176.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.764 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -43.0 -66.39 0.38 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.484 -1.235 . . . . 5.34 111.874 -177.138 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.692 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.1 m -61.24 -9.48 2.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 112.469 0.544 . . . . 5.53 112.469 -173.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.657 ' HG3' ' O ' ' A' ' 20' ' ' MET . 25.9 mt-10 -83.63 -55.71 4.13 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.477 -0.934 . . . . 5.18 108.477 168.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . 0.982 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 p-90 -70.09 -19.67 63.25 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 113.609 0.966 . . . . 4.35 113.609 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.692 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.2 mt -48.81 -34.21 11.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 120.119 -0.632 . . . . 4.82 109.785 173.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.46 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.5 mpt_? -101.59 -25.13 13.99 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.19 -0.913 . . . . 6.77 112.285 -171.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.982 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.1 pttt -98.48 3.33 48.23 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.814 -0.354 . . . . 5.19 111.325 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.578 ' CG ' ' HB2' ' A' ' 25' ' ' TRP . 75.0 mmtt -122.39 -31.96 3.71 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.241 0.46 . . . . 6.34 112.241 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.726 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -63.87 -36.67 84.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 121.254 0.549 . . . . 5.5 110.531 -175.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.737 ' NE2' HD21 ' A' ' 35' ' ' ASN . 0.7 OUTLIER -161.69 32.03 0.13 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.127 -0.942 . . . . 5.4 108.877 170.297 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.442 ' O ' ' HB ' ' A' ' 33' ' ' VAL . 6.0 p-10 38.08 -149.37 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 113.751 -1.568 . . . . 4.65 111.974 -175.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' A' ' 34' ' ' HIS . 54.1 t 71.84 -14.8 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 N-CA-C 112.382 0.512 . . . . 5.8 112.382 172.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 33' ' ' VAL . 50.2 m80 72.82 18.41 4.13 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.163 0.585 . . . . 8.88 109.778 -174.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.737 HD21 ' NE2' ' A' ' 31' ' ' GLN . 12.1 m120 67.56 96.28 0.06 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 114.714 -1.13 . . . . 4.98 112.073 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.425 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 2.8 m-85 -114.17 -50.93 0.05 OUTLIER Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 114.824 -1.08 . . . . 6.77 110.698 176.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.587 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 51.2 Cg_exo -56.27 -48.08 21.12 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 121.868 1.712 . . . . 7.44 112.713 170.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.587 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 2.7 Cg_exo -77.68 141.79 19.87 Favored 'Trans proline' 0 C--N 1.356 0.965 0 C-N-CA 122.025 1.816 . . . . 7.84 111.18 171.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.367 -0.825 . . . . 11.49 111.31 -176.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.794 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--O 1.22 -0.493 0 N-CA-C 112.194 0.442 . . . . 2.71 112.194 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.6 t -59.9 -18.9 48.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.007 0.432 . . . . 5.0899999999999999 110.214 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.473 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.9 ptp -85.64 -24.62 27.01 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.933 -0.576 . . . . 5.6500000000000004 109.569 176.185 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.683 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 9.5 mm-40 -75.67 -52.66 10.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.178 -0.919 . . . . 4.3099999999999996 109.74 176.053 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.808 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.8 mpt_? -48.33 -64.78 0.7 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.127 -0.942 . . . . 4.6200000000000001 111.808 -174.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.613 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 15.9 m -53.05 -18.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.902 0.751 . . . . 4.8300000000000001 112.138 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.525 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 16.8 mm-40 -89.07 -47.97 7.73 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.218 0.532 . . . . 5.1799999999999997 110.335 177.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.808 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 30.6 p-90 -71.59 -15.53 62.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 118.284 -1.366 . . . . 3.6699999999999999 112.675 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.613 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.3 mt -46.75 -39.52 11.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 120.228 -0.589 . . . . 4.2800000000000002 110.493 173.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.525 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -92.66 -9.28 41.45 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.37 -0.832 . . . . 5.96 111.308 -167.957 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.726 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 62.2 pttt -115.25 7.54 15.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.093 -0.503 . . . . 4.7800000000000002 110.439 173.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.434 ' HD3' ' O ' ' A' ' 28' ' ' LYS . 33.3 mmtp -136.1 -37.54 0.72 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.891 1.071 . . . . 5.96 113.891 -178.038 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -48.76 -49.05 40.27 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 122.033 0.92 . . . . 5.5 109.696 -172.472 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.785 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -156.99 17.94 0.3 Allowed 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.167 -2.16 . . . . 4.6699999999999999 105.167 163.815 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.557 ' HB2' ' C ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.508 -0.637 0 CA-C-N 111.291 -2.686 . . . . 4.6500000000000004 112.57 -166.072 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.784 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 97.0 m-20 . . . . . 0 C--O 1.222 -0.365 0 N-CA-C 112.948 0.721 . . . . 2.71 112.948 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.513 ' HA ' ' CD ' ' A' ' 22' ' ' ARG . 74.4 m -71.44 2.11 5.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.817 0.341 . . . . 5.0899999999999999 111.539 178.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.29 -7.3 26.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.226 -1.027 . . . . 5.6500000000000004 108.226 171.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 48.6 mm-40 -96.43 -46.66 6.29 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.976 -1.465 . . . . 4.3099999999999996 109.22 173.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.794 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.6 mpt_? -46.47 -65.75 0.51 Allowed 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 115.322 -0.853 . . . . 4.6200000000000001 111.754 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.991 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -57.41 -13.37 2.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 O-C-N 123.443 0.464 . . . . 4.8300000000000001 111.809 -174.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.507 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 7.3 mm-40 -92.45 -33.34 14.56 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.382 0.611 . . . . 5.1799999999999997 110.14 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.918 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 33.6 p-90 -83.99 -11.15 57.24 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 118.126 -1.43 . . . . 3.6699999999999999 111.809 172.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.991 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.5 mt -62.24 -6.15 2.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.154 0.427 . . . . 4.2800000000000002 112.154 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.507 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -110.01 -42.33 4.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.347 -0.388 . . . . 5.96 110.803 176.206 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.918 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 60.8 pttt -80.96 -21.27 40.51 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 111.758 0.281 . . . . 4.7800000000000002 111.758 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 11.7 mmpt? -101.23 -23.79 14.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.843 0.354 . . . . 5.96 110.665 176.179 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.005 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 38.4 tp -52.13 -59.53 4.27 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.492 -0.776 . . . . 5.5 111.315 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 1.005 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -164.09 22.23 0.07 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.589 -1.187 . . . . 4.6699999999999999 108.728 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.653 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 3.6 p30 . . . . . 0 N--CA 1.468 0.426 0 O-C-N 125.305 1.628 . . . . 4.6500000000000004 115.274 -172.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.688 ' HB3' ' HG3' ' A' ' 21' ' ' GLU . 70.6 m-20 . . . . . 0 N--CA 1.439 -1.023 0 N-CA-C 108.623 -0.88 . . . . 2.71 108.623 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.7 p -64.03 -5.83 5.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.929 -1.032 . . . . 5.0899999999999999 111.63 -175.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -90.82 -28.64 18.06 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.048 -0.723 . . . . 5.6500000000000004 109.048 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.688 ' HG3' ' HB3' ' A' ' 18' ' ' ASN . 30.3 mt-10 -71.02 -56.4 6.23 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.597 -1.183 . . . . 4.3099999999999996 109.133 171.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.845 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 1.4 mmt180 -46.6 -69.63 0.12 Allowed 'General case' 0 CA--C 1.508 -0.671 0 CA-C-N 112.786 -2.006 . . . . 4.6200000000000001 113.165 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.729 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -55.97 -15.19 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 124.091 0.869 . . . . 4.8300000000000001 112.221 -168.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 11.5 mt-10 -89.74 -45.55 9.22 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.072 0.463 . . . . 5.1799999999999997 110.123 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.845 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 35.2 p-90 -74.6 -17.11 60.76 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 118.612 -1.235 . . . . 3.6699999999999999 112.391 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.729 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.7 mt -47.68 -30.74 4.01 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.233 0.539 . . . . 4.2800000000000002 111.244 175.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -99.37 -33.21 10.8 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.534 -0.757 . . . . 5.96 111.469 -171.755 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.808 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 58.9 pttt -88.08 -0.8 57.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.942 0.401 . . . . 4.7800000000000002 110.762 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.491 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 31.6 mmmt -116.96 -28.92 6.14 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.165 0.431 . . . . 5.96 112.165 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.909 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -69.27 -35.5 76.14 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-O 121.437 0.637 . . . . 5.5 110.328 -173.779 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.909 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -158.73 16.4 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.013 -0.994 . . . . 4.6699999999999999 109.303 175.589 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.563 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 4.7 p-10 . . . . . 0 N--CA 1.472 0.64 0 O-C-N 125.41 1.694 . . . . 4.6500000000000004 112.626 -167.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.64 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 40.2 m-20 . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 120.757 0.313 . . . . 2.71 110.36 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.3 t -67.87 -5.5 17.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.403 -0.362 . . . . 5.0899999999999999 110.31 -178.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.3 ptm -99.94 -16.97 17.79 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 122.309 1.052 . . . . 5.6500000000000004 108.511 178.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 58.9 mt-10 -84.69 -59.51 2.34 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.184 -1.825 . . . . 4.3099999999999996 110.009 175.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.807 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 3.5 mpt_? -48.31 -62.65 1.38 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 115.122 -0.945 . . . . 4.6200000000000001 112.521 -176.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.792 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.6 m -60.67 -6.94 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 123.783 0.677 . . . . 4.8300000000000001 112.471 -166.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -94.73 -41.87 9.04 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.35 -0.611 . . . . 5.1799999999999997 109.35 175.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.807 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 40.6 p-90 -80.78 -16.71 53.07 Favored 'General case' 0 CA--C 1.504 -0.819 0 C-N-CA 118.935 -1.106 . . . . 3.6699999999999999 112.834 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.792 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.8 mt -49.43 -31.12 9.09 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 120.87 0.366 . . . . 4.2800000000000002 111.317 176.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.748 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.85 -37.55 9.39 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.036 0.446 . . . . 5.96 110.952 -170.369 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.758 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -84.08 1.92 41.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.179 -0.464 . . . . 4.7800000000000002 111.373 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.55 ' HD2' ' O ' ' A' ' 28' ' ' LYS . 13.9 mmmm -128.28 -24.55 3.09 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 112.964 0.727 . . . . 5.96 112.964 179.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.748 HD23 ' HA ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -59.8 -36.47 76.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.039 0.923 . . . . 5.5 109.471 -175.181 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.547 ' HG3' ' CD1' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -159.22 5.73 0.1 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.685 -1.598 . . . . 4.6699999999999999 107.347 169.567 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.551 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.536 0 CA-C-N 113.32 -1.764 . . . . 4.6500000000000004 111.814 -166.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.807 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 87.3 m-20 . . . . . 0 N--CA 1.449 -0.516 0 CA-C-O 119.651 -0.214 . . . . 2.71 110.479 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.485 ' H ' ' CD ' ' A' ' 22' ' ' ARG . 22.7 t 62.19 -53.91 0.14 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.007 0.817 . . . . 5.0899999999999999 111.672 -174.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.435 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.7 ptp -77.75 -27.26 50.38 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 108.022 -1.103 . . . . 5.6500000000000004 108.022 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.807 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 49.0 mt-10 -80.36 -46.03 16.76 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 113.418 -1.719 . . . . 4.3099999999999996 110.963 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.802 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.7 OUTLIER -48.83 -63.14 1.18 Allowed 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 123.566 0.541 . . . . 4.6200000000000001 111.147 179.595 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.788 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 30.8 m -64.22 3.62 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 115.554 -0.748 . . . . 4.8300000000000001 112.376 -169.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 20' ' ' MET . 10.8 mt-10 -100.31 -45.54 5.56 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.104 -0.702 . . . . 5.1799999999999997 109.104 169.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.887 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 42.7 p-90 -77.79 -18.9 55.9 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 119.494 -0.883 . . . . 3.6699999999999999 112.726 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.788 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.0 mt -50.35 -28.12 7.42 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 121.126 0.488 . . . . 4.2800000000000002 111.099 176.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.802 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -103.15 -42.79 5.66 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.592 -0.731 . . . . 5.96 111.0 -172.217 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.887 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.5 pttt -78.32 -5.57 52.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.577 -0.283 . . . . 4.7800000000000002 111.378 -177.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.437 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 14.1 mmmm -114.87 -34.33 5.15 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.6 -0.44 . . . . 5.96 112.009 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.941 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -57.64 -38.72 75.51 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.948 0.404 . . . . 5.5 110.96 -175.12 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.941 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -159.2 23.17 0.2 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.611 -0.722 . . . . 4.6699999999999999 109.428 175.678 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 CA--C 1.515 -0.377 0 CA-C-N 113.906 -1.497 . . . . 4.6500000000000004 112.229 -167.68 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.66 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 21.6 m120 . . . . . 0 CA--C 1.506 -0.743 0 CA-C-O 121.074 0.464 . . . . 2.71 111.47 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.9 t -61.89 -32.49 72.86 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.5 -0.773 . . . . 5.0899999999999999 109.066 177.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.783 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 27.9 ptm -76.01 -45.45 34.48 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.863 -0.608 . . . . 5.6500000000000004 110.085 178.17 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.66 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 5.9 mp0 -48.71 -57.95 5.51 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.389 0.614 . . . . 4.3099999999999996 109.736 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.704 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -53.19 -64.33 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.33 -1.305 . . . . 4.6200000000000001 111.945 177.541 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.896 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 10.6 p -55.01 -19.38 4.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 123.587 0.554 . . . . 4.8300000000000001 111.773 -172.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.783 ' HG2' ' O ' ' A' ' 20' ' ' MET . 8.7 mm-40 -75.04 -58.73 3.1 Favored 'General case' 0 CA--C 1.504 -0.815 0 O-C-N 121.612 -0.68 . . . . 5.1799999999999997 109.255 169.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.76 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 29.6 p-90 -69.27 -14.09 62.76 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 113.784 1.031 . . . . 3.6699999999999999 113.784 -174.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.896 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.6 mt -49.68 -42.21 44.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.275 1.036 . . . . 4.2800000000000002 108.253 170.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.612 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.3 mpt_? -99.16 22.39 10.5 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.569 -1.196 . . . . 5.96 111.493 -170.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.76 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 55.9 pttt -131.81 -21.79 2.42 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.133 -0.485 . . . . 4.7800000000000002 111.017 162.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.638 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -160.62 19.32 0.14 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 115.063 1.505 . . . . 5.96 115.063 -175.206 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.973 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -62.48 -42.61 99.6 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.522 1.056 . . . . 5.5 109.334 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.973 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -163.77 102.36 0.9 Allowed 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.125 -2.176 . . . . 4.6699999999999999 105.125 169.305 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 C--N 1.318 -0.789 0 CA-C-O 122.587 1.184 . . . . 4.6500000000000004 111.857 -168.194 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.711 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 10.5 m120 . . . . . 0 N--CA 1.439 -0.976 0 CA-C-O 121.49 0.662 . . . . 2.71 109.832 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.3 m -69.16 -3.89 15.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.944 -1.026 . . . . 5.0899999999999999 110.82 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 22.3 ptt? -95.24 -22.64 17.67 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.176 -1.046 . . . . 5.6500000000000004 108.176 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -85.93 -52.66 5.58 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.394 -1.73 . . . . 4.3099999999999996 109.854 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.887 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -45.04 -63.45 0.92 Allowed 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.99 -1.004 . . . . 4.6200000000000001 111.82 -178.544 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.8 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.3 m -62.55 -3.34 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.877 -0.602 . . . . 4.8300000000000001 112.336 -169.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 9.0 mm-40 -96.6 -44.79 6.99 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.586 0.708 . . . . 5.1799999999999997 109.496 172.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.887 ' CZ2' ' HG3' ' A' ' 22' ' ' ARG . 42.6 p-90 -77.66 -18.11 57.03 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 118.853 -1.139 . . . . 3.6699999999999999 112.95 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.8 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.5 mt -48.46 -33.41 9.31 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 121.072 0.463 . . . . 4.2800000000000002 110.935 175.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.589 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.81 -35.82 10.0 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.433 -0.803 . . . . 5.96 111.156 -170.473 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.861 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -85.69 -7.01 59.05 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.679 -0.408 . . . . 4.7800000000000002 111.651 -177.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 30.0 mmmt -118.95 -9.47 10.07 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 119.931 -0.708 . . . . 5.96 112.21 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.711 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -87.45 -36.11 17.88 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 119.94 -0.704 . . . . 5.5 110.082 -178.699 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.711 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -176.98 42.53 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.597 -0.729 . . . . 4.6699999999999999 109.589 176.165 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.571 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 9.6 p-10 . . . . . 0 N--CA 1.471 0.603 0 O-C-N 125.083 1.489 . . . . 4.6500000000000004 114.444 -165.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.564 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 30.4 m-20 . . . . . 0 C--O 1.22 -0.483 0 N-CA-C 111.856 0.317 . . . . 2.71 111.856 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.969 ' HA ' ' HG2' ' A' ' 22' ' ' ARG . 21.3 m -74.71 -6.02 46.47 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.935 -0.478 . . . . 5.0899999999999999 110.238 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.489 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 2.4 ptt? -94.55 -26.17 16.52 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.052 -1.092 . . . . 5.6500000000000004 108.052 171.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 59.1 mm-40 -68.39 -47.45 67.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.636 -1.165 . . . . 4.3099999999999996 109.583 172.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.969 ' HG2' ' HA ' ' A' ' 19' ' ' SER . 22.8 mmt85 -41.5 -69.74 0.13 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 114.872 -1.058 . . . . 4.6200000000000001 110.976 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.676 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 12.2 m -64.2 4.08 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.234 -0.894 . . . . 4.8300000000000001 112.836 -174.245 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 20' ' ' MET . 17.6 mt-10 -95.54 -52.22 4.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.267 -1.012 . . . . 5.1799999999999997 108.267 163.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 1.023 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 43.9 p-90 -71.97 -22.81 61.39 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 113.491 0.923 . . . . 3.6699999999999999 113.491 -175.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.676 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.4 mt -55.37 -31.39 61.74 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 119.294 -0.962 . . . . 4.2800000000000002 108.514 172.287 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 32' ' ' ASP . 2.5 mpt_? -110.3 -7.07 14.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 113.718 1.007 . . . . 5.96 113.718 -171.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 1.023 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 45.6 pttt -113.38 -1.96 14.09 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 119.824 -0.751 . . . . 4.7800000000000002 110.739 174.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.473 ' CG ' ' HB2' ' A' ' 25' ' ' TRP . 14.7 mmmm -124.06 -26.86 3.96 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.092 0.775 . . . . 5.96 113.092 -173.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.933 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -66.73 -42.23 86.62 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.932 0.872 . . . . 5.5 110.29 -175.093 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.933 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -172.7 21.23 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 105.723 -1.955 . . . . 4.6699999999999999 105.723 175.765 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' A' ' 27' ' ' ARG . 9.6 p-10 . . . . . 0 C--O 1.214 -0.779 0 CA-C-N 111.851 -2.432 . . . . 4.6500000000000004 113.57 -167.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.712 ' HB2' HH21 ' A' ' 22' ' ' ARG . 13.2 m120 . . . . . 0 N--CA 1.447 -0.601 0 N-CA-C 109.976 -0.379 . . . . 2.71 109.976 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 p -65.38 -14.75 61.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.763 -0.653 . . . . 5.0899999999999999 110.943 -177.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 4.9 ptm -91.34 -24.38 19.81 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.797 -0.638 . . . . 5.6500000000000004 109.602 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.657 ' CG ' ' HB3' ' A' ' 18' ' ' ASN . 22.3 mm-40 -73.2 -52.89 12.43 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.101 -0.954 . . . . 4.3099999999999996 109.642 173.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.719 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 6.7 mmt180 -42.87 -68.7 0.17 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 113.699 -1.591 . . . . 4.6200000000000001 111.8 -174.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.689 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 m -56.55 -13.13 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 113.037 0.755 . . . . 4.8300000000000001 113.037 -171.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.99 -35.78 16.2 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.425 0.631 . . . . 5.1799999999999997 109.816 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 0.719 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 50.7 p-90 -90.32 -8.88 49.72 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 118.927 -1.109 . . . . 3.6699999999999999 113.041 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.689 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 5.5 mt -67.77 11.9 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 4.2800000000000002 112.771 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.575 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -126.49 -62.52 1.14 Allowed 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.164 -1.05 . . . . 5.96 108.164 173.187 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.661 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 52.7 pttt -61.13 -25.45 67.0 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.412 -0.813 . . . . 4.7800000000000002 113.19 -176.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.616 ' HG2' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -129.37 -17.11 3.81 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.252 0.834 . . . . 5.96 113.252 -176.961 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.06 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.3 OUTLIER -49.21 -39.9 31.59 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.12 0.486 . . . . 5.5 111.34 -172.138 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 1.06 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -167.66 -1.44 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.287 -0.869 . . . . 4.6699999999999999 110.309 173.13 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.413 ' H ' ' H ' ' A' ' 31' ' ' GLN . 31.8 t0 . . . . . 0 N--CA 1.462 0.132 0 CA-C-N 114.389 -1.278 . . . . 4.6500000000000004 111.566 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.758 ' O ' ' HD3' ' A' ' 22' ' ' ARG . 98.1 m-20 . . . . . 0 C--O 1.222 -0.376 0 CA-C-O 120.75 0.31 . . . . 2.71 110.687 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.8 m -75.69 3.88 8.86 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.545 0.212 . . . . 5.0899999999999999 111.523 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.683 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.9 ptm -99.49 -36.58 9.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 107.912 -1.144 . . . . 5.6500000000000004 107.912 168.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 22.5 mm-40 -65.42 -56.48 12.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.787 -1.097 . . . . 4.3099999999999996 110.23 176.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.764 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -43.0 -66.39 0.38 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.484 -1.235 . . . . 4.6200000000000001 111.874 -177.138 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.761 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.1 m -61.24 -9.48 2.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 112.469 0.544 . . . . 4.8300000000000001 112.469 -173.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' A' ' 20' ' ' MET . 25.9 mt-10 -83.63 -55.71 4.13 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.477 -0.934 . . . . 5.1799999999999997 108.477 168.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TRP . . . . . 1.048 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 p-90 -70.09 -19.67 63.25 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 113.609 0.966 . . . . 3.6699999999999999 113.609 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.761 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.2 mt -48.81 -34.21 11.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 120.119 -0.632 . . . . 4.2800000000000002 109.785 173.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.5 mpt_? -101.59 -25.13 13.99 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.19 -0.913 . . . . 5.96 112.285 -171.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 1.048 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.1 pttt -98.48 3.33 48.23 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.814 -0.354 . . . . 4.7800000000000002 111.325 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.628 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 75.0 mmtt -122.39 -31.96 3.71 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.241 0.46 . . . . 5.96 112.241 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.74 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -63.87 -36.67 84.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 121.254 0.549 . . . . 5.5 110.531 -175.39 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.74 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -161.69 32.03 0.13 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.127 -0.942 . . . . 4.6699999999999999 108.877 170.297 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.429 ' HA ' ' C ' ' A' ' 28' ' ' LYS . 6.0 p-10 . . . . . 0 N--CA 1.47 0.541 0 CA-C-N 113.751 -1.568 . . . . 4.6500000000000004 111.974 -175.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.476 ' HB3' ' HG ' ' A' ' 9' ' ' LEU . 3.9 Cg_endo . . . . . 0 N--CA 1.478 0.58 0 N-CA-C 110.8 -0.5 . . . . 7.0099999999999998 110.8 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -88.79 -151.12 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 123.219 2.613 . . . . 8.0399999999999991 111.98 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.49 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 17.1 m -65.43 -23.05 66.84 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.047 0.388 . . . . 8.5199999999999996 112.047 -175.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.0 p -70.33 -22.68 24.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-O 121.026 0.441 . . . . 8.2100000000000009 111.393 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.808 ' HB2' HD23 ' A' ' 9' ' ' LEU . 4.0 p -126.55 21.79 7.08 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.879 0.326 . . . . 4.7699999999999996 111.879 -177.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.573 ' O ' ' HB2' ' A' ' 10' ' ' MET . 7.9 pt-20 -74.6 2.19 10.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.96 0.409 . . . . 6.3700000000000001 110.912 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.4 mm -99.17 -57.36 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.3 0.571 . . . . 6.54 110.326 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.521 ' HG2' HD22 ' A' ' 9' ' ' LEU . 18.3 pm0 -85.69 -32.17 22.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.427 -0.806 . . . . 6.54 111.586 -175.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.808 HD23 ' HB2' ' A' ' 5' ' ' SER . 4.3 mm? -87.49 -29.57 21.28 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.685 -0.406 . . . . 5.6799999999999997 110.691 177.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.739 ' SD ' ' HE3' ' A' ' 15' ' ' LYS . 67.5 mtt -109.72 104.82 13.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.834 0.35 . . . . 5.3499999999999996 110.862 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -100.79 -16.11 17.41 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.395 -0.595 . . . . 7.5599999999999996 109.395 175.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -58.65 -39.09 79.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.812 -1.085 . . . . 5.9400000000000004 109.273 170.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.415 HH21 ' HG3' ' A' ' 21' ' ' GLU . 27.3 mmm180 54.7 -154.65 0.27 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.341 -0.845 . . . . 5.4500000000000002 111.814 172.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' H ' ' HB3' ' A' ' 13' ' ' ARG . . . 63.02 51.26 56.7 Favored Glycine 0 C--O 1.227 -0.337 0 N-CA-C 110.554 -1.018 . . . . 4.8099999999999996 110.554 -174.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.739 ' HE3' ' SD ' ' A' ' 10' ' ' MET . 71.1 mmtt -101.07 -12.45 18.82 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 113.12 0.785 . . . . 8.3499999999999996 113.12 -167.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -147.56 -80.93 0.14 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.432 -1.321 . . . . 4.7199999999999998 107.432 175.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.456 ' C ' ' H ' ' A' ' 19' ' ' SER . 13.7 tp -125.0 -45.45 1.87 Allowed 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.803 -1.09 . . . . 4.8799999999999999 109.699 170.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.794 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 0.9 OUTLIER 69.25 -22.28 0.15 Allowed 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 115.383 -0.826 . . . . 2.71 112.194 174.79 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.456 ' H ' ' C ' ' A' ' 17' ' ' LEU . 8.6 t -59.9 -18.9 48.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.007 0.432 . . . . 5.0899999999999999 110.214 175.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.473 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.9 ptp -85.64 -24.62 27.01 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.933 -0.576 . . . . 5.6500000000000004 109.569 176.185 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.683 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 9.5 mm-40 -75.67 -52.66 10.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.178 -0.919 . . . . 4.3099999999999996 109.74 176.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.808 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.8 mpt_? -48.33 -64.78 0.7 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.127 -0.942 . . . . 4.6200000000000001 111.808 -174.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.613 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 15.9 m -53.05 -18.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.902 0.751 . . . . 4.8300000000000001 112.138 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.525 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 16.8 mm-40 -89.07 -47.97 7.73 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.218 0.532 . . . . 5.1799999999999997 110.335 177.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.808 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 30.6 p-90 -71.59 -15.53 62.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 118.284 -1.366 . . . . 3.6699999999999999 112.675 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.613 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.3 mt -46.75 -39.52 11.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 120.228 -0.589 . . . . 4.2800000000000002 110.493 173.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.525 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -92.66 -9.28 41.45 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.37 -0.832 . . . . 5.96 111.308 -167.957 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.726 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 62.2 pttt -115.25 7.54 15.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.093 -0.503 . . . . 4.7800000000000002 110.439 173.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.434 ' HD3' ' O ' ' A' ' 28' ' ' LYS . 33.3 mmtp -136.1 -37.54 0.72 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.891 1.071 . . . . 5.96 113.891 -178.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -48.76 -49.05 40.27 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 122.033 0.92 . . . . 5.5 109.696 -172.472 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.785 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -156.99 17.94 0.3 Allowed 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.167 -2.16 . . . . 4.6699999999999999 105.167 163.815 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.557 ' HB2' ' C ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 38.8 107.91 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.637 0 CA-C-N 111.291 -2.686 . . . . 4.6500000000000004 112.57 -166.072 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.428 HG12 ' O ' ' A' ' 27' ' ' ARG . 5.0 p -71.37 -9.24 12.6 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 CA-C-N 112.549 -2.114 . . . . 5.0 111.232 -166.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -66.59 -9.47 35.71 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.056 -0.52 . . . . 8.0899999999999999 111.765 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -78.79 5.8 10.48 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.358 0.503 . . . . 4.29 112.358 -175.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.442 ' CB ' ' HD3' ' A' ' 37' ' ' PRO . 3.2 m-85 -57.17 -57.93 21.4 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 120.738 -0.385 . . . . 5.9800000000000004 110.933 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.656 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 27.4 Cg_exo -63.18 -52.76 1.86 Allowed 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 121.482 1.455 . . . . 7.4400000000000004 112.796 168.448 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 46.0 Cg_exo -64.34 38.86 0.1 Allowed 'Trans proline' 0 C--N 1.367 1.546 0 C-N-CA 123.749 2.966 . . . . 7.5700000000000003 115.063 174.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.3 t70 . . . . . 0 C--O 1.245 0.838 0 CA-C-O 118.498 -0.763 . . . . 11.49 109.97 176.986 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.48 0.71 0 N-CA-C 111.283 -0.314 . . . . 7.0099999999999998 111.283 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -71.95 -64.61 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.828 2.352 . . . . 8.0399999999999991 112.036 177.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 67.1 m -121.3 27.47 8.33 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.36 0.6 . . . . 8.5199999999999996 110.337 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.8 t -79.64 -66.34 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.731 -0.668 . . . . 8.2100000000000009 110.708 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.85 ' HB2' ' HB2' ' A' ' 9' ' ' LEU . 13.2 p -92.59 -15.67 26.61 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.303 -0.408 . . . . 4.7699999999999996 112.035 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -66.12 16.87 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.236 0.828 . . . . 6.3700000000000001 113.236 -174.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.461 ' H ' ' C ' ' A' ' 5' ' ' SER . 28.4 mm -107.66 -46.22 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 CA-C-O 120.739 0.304 . . . . 6.54 110.659 175.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.445 ' H ' ' NE2' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -113.12 -23.42 10.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.511 0.672 . . . . 6.54 109.622 -177.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.85 ' HB2' ' HB2' ' A' ' 5' ' ' SER . 54.1 mt -110.14 27.59 9.46 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.161 -0.927 . . . . 5.6799999999999997 109.871 177.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 63.8 mtt -33.59 109.39 0.07 Allowed 'General case' 0 C--N 1.346 0.446 0 O-C-N 123.716 0.635 . . . . 5.3499999999999996 111.342 170.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -80.22 11.93 3.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.314 0.578 . . . . 7.5599999999999996 110.608 -178.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -74.1 -12.37 60.58 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.67 -0.695 . . . . 5.9400000000000004 110.955 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 13' ' ' ARG . 6.6 mpt_? -65.71 -31.26 72.16 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.366 -0.379 . . . . 5.4500000000000002 110.756 175.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -151.82 101.87 0.22 Allowed Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.952 -0.642 . . . . 4.8099999999999996 112.034 -177.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.429 ' HB2' ' HE2' ' A' ' 15' ' ' LYS . 14.0 ptmm? -125.67 -0.08 7.45 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.066 0.46 . . . . 8.3499999999999996 110.595 177.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -158.63 -133.14 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.292 -1.003 . . . . 4.7199999999999998 108.292 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.34 -64.05 1.03 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.73 -0.47 . . . . 4.8799999999999999 109.73 175.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.784 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 11.3 m120 69.32 -17.24 0.22 Allowed 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.426 -0.806 . . . . 2.71 112.948 169.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.513 ' HA ' ' CD ' ' A' ' 22' ' ' ARG . 74.4 m -71.44 2.11 5.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.817 0.341 . . . . 5.0899999999999999 111.539 178.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.29 -7.3 26.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.226 -1.027 . . . . 5.6500000000000004 108.226 171.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 48.6 mm-40 -96.43 -46.66 6.29 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.976 -1.465 . . . . 4.3099999999999996 109.22 173.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.794 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.6 mpt_? -46.47 -65.75 0.51 Allowed 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 115.322 -0.853 . . . . 4.6200000000000001 111.754 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.991 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -57.41 -13.37 2.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 O-C-N 123.443 0.464 . . . . 4.8300000000000001 111.809 -174.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.507 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 7.3 mm-40 -92.45 -33.34 14.56 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.382 0.611 . . . . 5.1799999999999997 110.14 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.918 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 33.6 p-90 -83.99 -11.15 57.24 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 118.126 -1.43 . . . . 3.6699999999999999 111.809 172.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.991 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.5 mt -62.24 -6.15 2.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.154 0.427 . . . . 4.2800000000000002 112.154 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.515 ' HB3' ' ND2' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -110.01 -42.33 4.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.347 -0.388 . . . . 5.96 110.803 176.206 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.918 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 60.8 pttt -80.96 -21.27 40.51 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 111.758 0.281 . . . . 4.7800000000000002 111.758 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 11.7 mmpt? -101.23 -23.79 14.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.843 0.354 . . . . 5.96 110.665 176.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.005 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 38.4 tp -52.13 -59.53 4.27 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.492 -0.776 . . . . 5.5 111.315 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 1.005 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -164.09 22.23 0.07 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.589 -1.187 . . . . 4.6699999999999999 108.728 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.653 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 3.6 p30 13.66 97.95 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 125.305 1.628 . . . . 4.6500000000000004 115.274 -172.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 31' ' ' GLN . 55.4 t -139.68 -55.48 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 113.734 -1.575 . . . . 5.0 111.14 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -93.83 34.53 1.21 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.688 0.756 . . . . 8.0899999999999999 109.007 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.58 ' OD1' ' HA ' ' A' ' 28' ' ' LYS . 1.1 p30 -172.11 62.0 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.839 -1.073 . . . . 4.29 110.678 -167.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.557 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 36.6 m-85 -81.49 -47.28 1.07 Allowed Pre-proline 0 C--N 1.317 -0.809 0 N-CA-C 112.14 0.422 . . . . 5.9800000000000004 112.14 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.557 ' HD2' ' N ' ' A' ' 36' ' ' PHE . 7.9 Cg_exo -41.64 -46.51 6.26 Favored 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 123.068 2.512 . . . . 7.4400000000000004 114.937 175.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -49.51 105.01 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.28 0 C-N-CA 122.572 2.181 . . . . 7.5700000000000003 113.531 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.5 t70 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.158 -0.925 . . . . 11.49 111.119 178.568 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.632 ' HB2' ' CG1' ' A' ' 4' ' ' VAL . 56.9 Cg_exo . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 119.803 -0.165 . . . . 7.0099999999999998 111.902 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' A' ' 1' ' ' PRO . 75.5 Cg_exo -17.97 -78.97 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.028 1 C-N-CA 126.187 4.592 . . . . 8.0399999999999991 115.181 -166.013 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.418 ' H ' ' HB2' ' A' ' 2' ' ' PRO . 3.9 t -128.49 -6.04 5.28 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.036 0.446 . . . . 8.5199999999999996 110.148 178.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.632 ' CG1' ' HB2' ' A' ' 1' ' ' PRO . 12.2 p -73.0 -39.48 57.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.151 -0.477 . . . . 8.2100000000000009 111.94 -177.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.626 ' HB2' ' HG ' ' A' ' 9' ' ' LEU . 32.6 p -70.07 -20.81 63.2 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 119.905 -0.718 . . . . 4.7699999999999996 112.003 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -64.53 -9.86 21.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.051 0.453 . . . . 6.3700000000000001 111.152 -175.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 mp -89.21 -42.91 14.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.024 -0.535 . . . . 6.54 110.599 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -89.25 -39.89 13.21 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 120.664 -0.415 . . . . 6.54 110.412 -174.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.626 ' HG ' ' HB2' ' A' ' 5' ' ' SER . 8.7 mt -74.86 -28.23 60.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.911 0.386 . . . . 5.6799999999999997 110.256 -178.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 62.0 mtt -123.82 86.28 2.55 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.358 -0.383 . . . . 5.3499999999999996 111.449 -177.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.46 ' C ' ' H ' ' A' ' 13' ' ' ARG . 72.5 m-70 -91.29 -5.72 54.26 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.023 -0.732 . . . . 7.5599999999999996 109.023 171.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -75.46 39.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.031 -0.986 . . . . 5.9400000000000004 109.957 170.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.46 ' H ' ' C ' ' A' ' 11' ' ' HIS . 29.2 mmm180 -46.98 -55.6 7.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.701 -1.136 . . . . 5.4500000000000002 112.181 -171.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.521 ' HA3' HD21 ' A' ' 18' ' ' ASN . . . -167.59 -48.49 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.218 -0.992 . . . . 4.8099999999999996 112.583 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 14' ' ' GLY . 56.0 mtpt 75.84 -39.82 0.39 Allowed 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.431 0.692 . . . . 8.3499999999999996 111.533 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -50.29 -82.95 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.467 0.651 . . . . 4.7199999999999998 111.781 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 19.8 tp -152.03 82.1 1.26 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 107.794 -1.188 . . . . 4.8799999999999999 107.794 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.688 ' HB3' ' HG3' ' A' ' 21' ' ' GLU . 10.9 m120 -90.79 57.66 3.62 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 108.623 -0.88 . . . . 2.71 108.623 -176.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.7 p -64.03 -5.83 5.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.929 -1.032 . . . . 5.0899999999999999 111.63 -175.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -90.82 -28.64 18.06 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.048 -0.723 . . . . 5.6500000000000004 109.048 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.688 ' HG3' ' HB3' ' A' ' 18' ' ' ASN . 30.3 mt-10 -71.02 -56.4 6.23 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.597 -1.183 . . . . 4.3099999999999996 109.133 171.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.845 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 1.4 mmt180 -46.6 -69.63 0.12 Allowed 'General case' 0 CA--C 1.508 -0.671 0 CA-C-N 112.786 -2.006 . . . . 4.6200000000000001 113.165 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.729 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -55.97 -15.19 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 124.091 0.869 . . . . 4.8300000000000001 112.221 -168.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 11.5 mt-10 -89.74 -45.55 9.22 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.072 0.463 . . . . 5.1799999999999997 110.123 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.845 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 35.2 p-90 -74.6 -17.11 60.76 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 118.612 -1.235 . . . . 3.6699999999999999 112.391 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.729 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.7 mt -47.68 -30.74 4.01 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.233 0.539 . . . . 4.2800000000000002 111.244 175.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -99.37 -33.21 10.8 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.534 -0.757 . . . . 5.96 111.469 -171.755 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.808 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 58.9 pttt -88.08 -0.8 57.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.942 0.401 . . . . 4.7800000000000002 110.762 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.491 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 31.6 mmmt -116.96 -28.92 6.14 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.165 0.431 . . . . 5.96 112.165 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.909 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -69.27 -35.5 76.14 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-O 121.437 0.637 . . . . 5.5 110.328 -173.779 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.909 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -158.73 16.4 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.013 -0.994 . . . . 4.6699999999999999 109.303 175.589 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.563 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 4.7 p-10 40.03 115.4 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 O-C-N 125.41 1.694 . . . . 4.6500000000000004 112.626 -167.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 33' ' ' VAL . 6.5 p -73.08 59.41 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-O 123.1 1.429 . . . . 5.0 111.695 -172.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -117.22 -14.89 10.47 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 113.597 -1.638 . . . . 8.0899999999999999 107.678 169.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -118.0 143.8 46.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.211 -1.359 . . . . 4.29 109.513 175.125 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.684 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 78.4 m-85 -105.06 -52.04 0.11 Allowed Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 116.489 -0.323 . . . . 5.9800000000000004 111.706 -178.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.684 ' HD3' ' HB2' ' A' ' 36' ' ' PHE . 98.6 Cg_endo -97.85 89.01 0.07 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.088 0 C-N-CA 122.643 2.229 . . . . 7.4400000000000004 112.358 170.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.668 ' HD3' ' O ' ' A' ' 36' ' ' PHE . 2.3 Cg_endo -85.04 52.79 3.47 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 123.299 2.666 . . . . 7.5700000000000003 111.478 -178.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.9 t70 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.793 -0.622 . . . . 11.49 110.327 -177.571 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo . . . . . 0 N--CA 1.484 0.952 0 N-CA-C 111.352 -0.288 . . . . 7.0099999999999998 111.352 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -66.97 -65.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.159 1.906 . . . . 8.0399999999999991 111.606 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.494 ' HA ' ' OE1' ' A' ' 6' ' ' GLU . 2.9 p -85.93 20.04 2.37 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.975 -0.557 . . . . 8.5199999999999996 111.368 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 94.4 t -103.42 -55.05 6.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.044 -0.525 . . . . 8.2100000000000009 109.909 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.491 ' HB2' ' HG ' ' A' ' 9' ' ' LEU . 55.5 p -87.71 -12.41 45.4 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.21 -0.45 . . . . 4.7699999999999996 112.154 -176.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.494 ' OE1' ' HA ' ' A' ' 3' ' ' SER . 10.4 pt-20 -59.57 -22.36 61.63 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 120.971 0.415 . . . . 6.3700000000000001 111.557 -177.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.4 mm -86.0 -36.59 10.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.086 -0.506 . . . . 6.54 111.957 -176.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -96.03 -41.94 8.5 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.368 -0.533 . . . . 6.54 110.465 -175.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.491 ' HG ' ' HB2' ' A' ' 5' ' ' SER . 12.7 mt -85.26 -23.99 27.96 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.104 -0.498 . . . . 5.6799999999999997 110.117 -177.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.412 ' C ' ' H ' ' A' ' 12' ' ' ASN . 54.9 mtt 48.28 91.39 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.354 0 O-C-N 123.74 0.65 . . . . 5.3499999999999996 111.746 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -71.54 6.6 1.77 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.259 0.552 . . . . 7.5599999999999996 110.482 -179.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.412 ' H ' ' C ' ' A' ' 10' ' ' MET . 35.3 p30 -87.43 10.5 17.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.507 -0.77 . . . . 5.9400000000000004 111.147 175.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' A' ' 21' ' ' GLU . 20.5 mmm180 -51.96 133.56 32.43 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.182 -1.044 . . . . 5.4500000000000002 108.182 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.34 -28.42 67.09 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.939 -0.573 . . . . 4.8099999999999996 113.653 -169.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp 60.91 17.74 8.12 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.432 0.634 . . . . 8.3499999999999996 110.243 -178.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -82.88 -76.88 0.26 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.111 -0.949 . . . . 4.7199999999999998 109.76 -176.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 19.8 tp -139.71 59.87 1.58 Allowed 'General case' 0 N--CA 1.436 -1.125 0 CA-C-N 114.901 -1.045 . . . . 4.8799999999999999 108.193 176.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.64 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 8.1 m120 -79.07 23.6 0.35 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.712 -0.676 . . . . 2.71 110.36 -176.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 17' ' ' LEU . 9.3 t -67.87 -5.5 17.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.403 -0.362 . . . . 5.0899999999999999 110.31 -178.114 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.3 ptm -99.94 -16.97 17.79 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 122.309 1.052 . . . . 5.6500000000000004 108.511 178.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 58.9 mt-10 -84.69 -59.51 2.34 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.184 -1.825 . . . . 4.3099999999999996 110.009 175.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.807 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 3.5 mpt_? -48.31 -62.65 1.38 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 115.122 -0.945 . . . . 4.6200000000000001 112.521 -176.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.792 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.6 m -60.67 -6.94 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 123.783 0.677 . . . . 4.8300000000000001 112.471 -166.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -94.73 -41.87 9.04 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.35 -0.611 . . . . 5.1799999999999997 109.35 175.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.807 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 40.6 p-90 -80.78 -16.71 53.07 Favored 'General case' 0 CA--C 1.504 -0.819 0 C-N-CA 118.935 -1.106 . . . . 3.6699999999999999 112.834 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.792 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.8 mt -49.43 -31.12 9.09 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 120.87 0.366 . . . . 4.2800000000000002 111.317 176.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.748 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.85 -37.55 9.39 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.036 0.446 . . . . 5.96 110.952 -170.369 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.758 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -84.08 1.92 41.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.179 -0.464 . . . . 4.7800000000000002 111.373 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.55 ' HD2' ' O ' ' A' ' 28' ' ' LYS . 13.9 mmmm -128.28 -24.55 3.09 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 112.964 0.727 . . . . 5.96 112.964 179.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.748 HD23 ' HA ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -59.8 -36.47 76.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.039 0.923 . . . . 5.5 109.471 -175.181 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.547 ' HG3' ' CD1' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -159.22 5.73 0.1 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.685 -1.598 . . . . 4.6699999999999999 107.347 169.567 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.551 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER 51.36 119.36 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 113.32 -1.764 . . . . 4.6500000000000004 111.814 -166.449 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.419 HG12 ' H ' ' A' ' 33' ' ' VAL . 2.5 p -68.9 -6.23 5.74 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 CA-C-N 113.752 -1.567 . . . . 5.0 112.4 -167.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -61.63 -28.39 69.34 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 122.113 -0.367 . . . . 8.0899999999999999 111.462 177.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 36' ' ' PHE . 1.2 p30 -99.85 -25.43 14.35 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.491 -0.322 . . . . 4.29 111.446 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' A' ' 35' ' ' ASN . 69.3 m-85 70.31 164.0 0.14 Allowed Pre-proline 0 C--O 1.234 0.281 0 O-C-N 124.166 0.916 . . . . 5.9800000000000004 110.026 -170.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.586 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 83.4 Cg_exo -44.7 -45.56 13.28 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.553 2.169 . . . . 7.4400000000000004 113.838 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 86.3 Cg_exo -51.92 91.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.361 1.233 0 C-N-CA 122.735 2.29 . . . . 7.5700000000000003 113.284 171.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.335 -0.841 . . . . 11.49 110.474 179.676 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo . . . . . 0 N--CA 1.482 0.841 0 N-CA-C 110.503 -0.614 . . . . 7.0099999999999998 110.503 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -72.46 -71.14 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.464 0 C-N-CA 122.926 2.417 . . . . 8.0399999999999991 113.304 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 p -131.26 -20.92 2.65 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.291 0.478 . . . . 8.5199999999999996 112.291 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.0 p -62.47 -22.03 28.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.138 0.494 . . . . 8.2100000000000009 111.169 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.924 ' HB3' HD23 ' A' ' 9' ' ' LEU . 30.4 m -92.52 3.29 55.8 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.214 -0.448 . . . . 4.7699999999999996 112.16 -178.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.629 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 42.4 mt-10 -71.86 26.4 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.953 -0.299 . . . . 6.3700000000000001 111.628 174.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.505 HD13 ' O ' ' A' ' 6' ' ' GLU . 29.7 mm -120.46 -59.25 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 121.444 0.64 . . . . 6.54 109.87 173.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.575 ' HG2' HD22 ' A' ' 9' ' ' LEU . 18.3 pm0 -83.86 -26.22 29.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.445 -0.798 . . . . 6.54 110.791 -177.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.924 HD23 ' HB3' ' A' ' 5' ' ' SER . 4.1 mm? -90.12 -49.88 6.32 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.52 -0.472 . . . . 5.6799999999999997 110.824 175.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.646 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 1.0 OUTLIER -86.19 106.03 17.01 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 120.924 0.393 . . . . 5.3499999999999996 110.893 -177.303 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -93.43 -2.89 54.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.557 0.694 . . . . 7.5599999999999996 109.365 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.469 ' OD1' ' HB3' ' A' ' 10' ' ' MET . 25.3 p-10 -79.6 8.27 6.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.979 -1.009 . . . . 5.9400000000000004 110.697 176.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 10' ' ' MET . 9.6 mmm180 -84.61 -41.55 16.28 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 120.984 0.421 . . . . 5.4500000000000002 110.427 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.7 -128.18 1.82 Allowed Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.916 -0.659 . . . . 4.8099999999999996 111.702 -176.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 15' ' ' LYS . 10.1 mmmm -136.6 126.21 25.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.332 0.11 . . . . 8.3499999999999996 111.019 -178.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 70.31 -72.41 0.11 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.315 0.579 . . . . 4.7199999999999998 111.951 174.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 tp -160.71 -47.67 0.05 OUTLIER 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.782 -0.822 . . . . 4.8799999999999999 108.782 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.807 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 11.8 m120 64.67 -90.02 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.661 -1.154 . . . . 2.71 110.479 -178.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.485 ' H ' ' CD ' ' A' ' 22' ' ' ARG . 22.7 t 62.19 -53.91 0.14 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.007 0.817 . . . . 5.0899999999999999 111.672 -174.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.435 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.7 ptp -77.75 -27.26 50.38 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 108.022 -1.103 . . . . 5.6500000000000004 108.022 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.807 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 49.0 mt-10 -80.36 -46.03 16.76 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 113.418 -1.719 . . . . 4.3099999999999996 110.963 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.802 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.7 OUTLIER -48.83 -63.14 1.18 Allowed 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 123.566 0.541 . . . . 4.6200000000000001 111.147 179.595 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.788 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 30.8 m -64.22 3.62 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 115.554 -0.748 . . . . 4.8300000000000001 112.376 -169.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 20' ' ' MET . 10.8 mt-10 -100.31 -45.54 5.56 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.104 -0.702 . . . . 5.1799999999999997 109.104 169.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.887 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 42.7 p-90 -77.79 -18.9 55.9 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 119.494 -0.883 . . . . 3.6699999999999999 112.726 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.788 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.0 mt -50.35 -28.12 7.42 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 121.126 0.488 . . . . 4.2800000000000002 111.099 176.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.802 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -103.15 -42.79 5.66 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.592 -0.731 . . . . 5.96 111.0 -172.217 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.887 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.5 pttt -78.32 -5.57 52.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.577 -0.283 . . . . 4.7800000000000002 111.378 -177.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.437 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 14.1 mmmm -114.87 -34.33 5.15 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.6 -0.44 . . . . 5.96 112.009 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.941 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -57.64 -38.72 75.51 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.948 0.404 . . . . 5.5 110.96 -175.12 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.941 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -159.2 23.17 0.2 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.611 -0.722 . . . . 4.6699999999999999 109.428 175.678 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 41.04 101.61 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 113.906 -1.497 . . . . 4.6500000000000004 112.229 -167.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.58 HG12 ' HA ' ' A' ' 28' ' ' LYS . 2.4 p -55.89 138.28 16.51 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 113.096 -1.866 . . . . 5.0 112.122 -173.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.424 ' HB3' ' O ' ' A' ' 33' ' ' VAL . 84.7 t60 82.47 -14.04 0.79 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.032 -1.44 . . . . 8.0899999999999999 110.026 -173.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 59.12 97.87 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.952 0.882 . . . . 4.29 111.602 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.86 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 77.7 m-85 -83.17 -57.22 0.44 Allowed Pre-proline 0 C--N 1.315 -0.897 0 CA-C-N 114.752 -1.113 . . . . 5.9800000000000004 111.367 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.86 ' HD3' ' HB2' ' A' ' 36' ' ' PHE . 34.2 Cg_exo -62.84 -52.67 2.1 Favored 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 122.217 1.945 . . . . 7.4400000000000004 114.184 174.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.513 ' HD3' ' HD2' ' A' ' 37' ' ' PRO . 12.5 Cg_exo -70.49 92.86 0.58 Allowed 'Trans proline' 0 C--N 1.363 1.29 0 C-N-CA 122.493 2.129 . . . . 7.5700000000000003 113.405 -174.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.7 t70 . . . . . 0 C--O 1.248 0.988 0 CA-C-N 115.69 -0.686 . . . . 11.49 110.205 173.13 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 N--CA 1.482 0.848 0 N-CA-C 110.814 -0.495 . . . . 7.0099999999999998 110.814 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.63 106.19 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.09 2.527 . . . . 8.0399999999999991 112.553 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.0 m 60.07 7.7 1.27 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.827 -1.078 . . . . 8.5199999999999996 111.97 -176.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 80.5 t -80.98 -42.38 20.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.209 0.528 . . . . 8.2100000000000009 109.79 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.557 ' HB2' HD22 ' A' ' 9' ' ' LEU . 52.8 p -121.84 -26.61 4.8 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.411 -0.516 . . . . 4.7699999999999996 112.025 174.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -56.64 -20.71 22.72 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.511 0.56 . . . . 6.3700000000000001 112.511 -172.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 24.9 mm -113.36 -18.68 7.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 111.994 0.368 . . . . 6.54 111.994 -177.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.721 ' HA ' ' HD3' ' A' ' 13' ' ' ARG . 2.2 mp0 -107.12 -26.19 11.22 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.297 -0.561 . . . . 6.54 111.758 -171.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.557 HD22 ' HB2' ' A' ' 5' ' ' SER . 10.4 mp -88.96 -15.73 33.5 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.25 0.548 . . . . 5.6799999999999997 109.882 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.57 122.74 19.12 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 108.632 -0.877 . . . . 5.3499999999999996 108.632 165.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -79.69 43.69 0.59 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.413 0.625 . . . . 7.5599999999999996 110.391 -176.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -113.35 15.56 19.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.891 -1.049 . . . . 5.9400000000000004 108.898 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.721 ' HD3' ' HA ' ' A' ' 8' ' ' GLN . 26.4 mmm180 -60.06 150.72 28.53 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.022 -0.99 . . . . 5.4500000000000002 110.93 -177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.9 -130.03 2.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.506 -0.854 . . . . 4.8099999999999996 112.491 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -92.71 -64.62 1.08 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.416 0.627 . . . . 8.3499999999999996 110.807 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -108.88 -54.52 2.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.37 -0.832 . . . . 4.7199999999999998 109.471 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.497 ' HG ' ' H ' ' A' ' 19' ' ' SER . 1.0 OUTLIER 177.55 -46.43 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 106.601 -1.629 . . . . 4.8799999999999999 106.601 -177.529 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.66 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 21.6 m120 53.81 32.86 15.74 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 113.073 -1.876 . . . . 2.71 111.47 166.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.497 ' H ' ' HG ' ' A' ' 17' ' ' LEU . 33.9 t -61.89 -32.49 72.86 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.5 -0.773 . . . . 5.0899999999999999 109.066 177.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.783 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 27.9 ptm -76.01 -45.45 34.48 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.863 -0.608 . . . . 5.6500000000000004 110.085 178.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.66 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 5.9 mp0 -48.71 -57.95 5.51 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.389 0.614 . . . . 4.3099999999999996 109.736 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.704 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -53.19 -64.33 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.33 -1.305 . . . . 4.6200000000000001 111.945 177.541 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.896 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 10.6 p -55.01 -19.38 4.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 123.587 0.554 . . . . 4.8300000000000001 111.773 -172.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.783 ' HG2' ' O ' ' A' ' 20' ' ' MET . 8.7 mm-40 -75.04 -58.73 3.1 Favored 'General case' 0 CA--C 1.504 -0.815 0 O-C-N 121.612 -0.68 . . . . 5.1799999999999997 109.255 169.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.76 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 29.6 p-90 -69.27 -14.09 62.76 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 113.784 1.031 . . . . 3.6699999999999999 113.784 -174.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.896 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.6 mt -49.68 -42.21 44.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.275 1.036 . . . . 4.2800000000000002 108.253 170.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.612 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.3 mpt_? -99.16 22.39 10.5 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.569 -1.196 . . . . 5.96 111.493 -170.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.76 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 55.9 pttt -131.81 -21.79 2.42 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.133 -0.485 . . . . 4.7800000000000002 111.017 162.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.638 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -160.62 19.32 0.14 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 115.063 1.505 . . . . 5.96 115.063 -175.206 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.973 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -62.48 -42.61 99.6 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.522 1.056 . . . . 5.5 109.334 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.973 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -163.77 102.36 0.9 Allowed 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.125 -2.176 . . . . 4.6699999999999999 105.125 169.305 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.643 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 4.2 p-10 -63.6 101.33 0.33 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.587 1.184 . . . . 4.6500000000000004 111.857 -168.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 79.6 t -135.59 -69.14 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 113.196 -1.82 . . . . 5.0 109.646 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -100.72 -13.61 18.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.95 0.881 . . . . 8.0899999999999999 109.029 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.643 ' OD1' ' HA ' ' A' ' 32' ' ' ASP . 0.9 OUTLIER -97.29 64.18 1.88 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.654 -1.157 . . . . 4.29 109.145 176.635 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.513 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.2 OUTLIER -101.8 -25.19 0.21 Allowed Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 114.041 1.126 . . . . 5.9800000000000004 114.041 -174.383 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 36' ' ' PHE . 37.0 Cg_exo -37.9 -42.53 1.39 Allowed 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.902 2.402 . . . . 7.4400000000000004 115.637 175.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 33.0 Cg_exo -61.57 84.15 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 122.294 1.996 . . . . 7.5700000000000003 113.047 173.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.7 t70 . . . . . 0 C--O 1.254 1.309 0 CA-C-O 118.369 -0.824 . . . . 11.49 111.476 176.172 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 0.676 0 N-CA-C 110.661 -0.553 . . . . 7.0099999999999998 110.661 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.461 ' HB2' ' H ' ' A' ' 3' ' ' SER . 6.2 Cg_exo -71.68 -96.11 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.555 2.17 . . . . 8.0399999999999991 111.696 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.551 ' HA ' ' HG2' ' A' ' 6' ' ' GLU . 67.5 m -78.29 1.56 21.3 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.242 0.544 . . . . 8.5199999999999996 110.571 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.36 -53.97 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 115.545 -0.752 . . . . 8.2100000000000009 109.931 172.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.805 ' HB3' ' HB2' ' A' ' 9' ' ' LEU . 16.0 m -141.17 19.35 2.26 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.945 0.72 . . . . 4.7699999999999996 112.945 -175.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.695 ' HG3' ' H ' ' A' ' 7' ' ' ILE . 6.3 pt-20 -47.92 -67.47 0.27 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.155 0.428 . . . . 6.3700000000000001 112.155 -177.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.695 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 27.4 mm -112.61 -1.08 9.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.044 0.449 . . . . 6.54 110.62 -177.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -92.22 -55.89 3.26 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.634 -0.426 . . . . 6.54 111.416 -171.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.805 ' HB2' ' HB3' ' A' ' 5' ' ' SER . 3.6 mm? -90.4 19.14 5.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.856 0.36 . . . . 5.6799999999999997 111.15 -176.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.617 ' HB2' ' HG2' ' A' ' 13' ' ' ARG . 21.0 mtt -63.02 114.24 3.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.006 -0.543 . . . . 5.3499999999999996 110.885 173.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -68.96 -11.84 61.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 122.01 0.91 . . . . 7.5599999999999996 108.65 170.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -65.91 -29.48 69.91 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.051 -1.431 . . . . 5.9400000000000004 111.208 172.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.617 ' HG2' ' HB2' ' A' ' 10' ' ' MET . 45.2 mmm-85 -59.97 -43.14 95.27 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.844 0.683 . . . . 5.4500000000000002 112.844 -171.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -148.06 153.26 25.17 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.149 -1.024 . . . . 4.8099999999999996 112.495 -175.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -105.95 -59.48 1.77 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.622 0.248 . . . . 8.3499999999999996 111.21 -178.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -123.85 49.03 1.79 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.205 -0.665 . . . . 4.7199999999999998 109.205 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 mm? 45.13 78.26 0.06 Allowed 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 122.373 1.082 . . . . 4.8799999999999999 112.182 -178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.711 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 10.5 m120 -93.09 30.48 1.62 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 113.997 -1.456 . . . . 2.71 109.832 -169.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.3 m -69.16 -3.89 15.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.944 -1.026 . . . . 5.0899999999999999 110.82 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 22.3 ptt? -95.24 -22.64 17.67 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.176 -1.046 . . . . 5.6500000000000004 108.176 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -85.93 -52.66 5.58 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.394 -1.73 . . . . 4.3099999999999996 109.854 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.887 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -45.04 -63.45 0.92 Allowed 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.99 -1.004 . . . . 4.6200000000000001 111.82 -178.544 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.8 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.3 m -62.55 -3.34 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.877 -0.602 . . . . 4.8300000000000001 112.336 -169.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 9.0 mm-40 -96.6 -44.79 6.99 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.586 0.708 . . . . 5.1799999999999997 109.496 172.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.887 ' CZ2' ' HG3' ' A' ' 22' ' ' ARG . 42.6 p-90 -77.66 -18.11 57.03 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 118.853 -1.139 . . . . 3.6699999999999999 112.95 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.8 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.5 mt -48.46 -33.41 9.31 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 121.072 0.463 . . . . 4.2800000000000002 110.935 175.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.589 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.81 -35.82 10.0 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.433 -0.803 . . . . 5.96 111.156 -170.473 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.861 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -85.69 -7.01 59.05 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.679 -0.408 . . . . 4.7800000000000002 111.651 -177.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 30.0 mmmt -118.95 -9.47 10.07 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 119.931 -0.708 . . . . 5.96 112.21 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.711 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -87.45 -36.11 17.88 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 119.94 -0.704 . . . . 5.5 110.082 -178.699 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.711 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -176.98 42.53 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.597 -0.729 . . . . 4.6699999999999999 109.589 176.165 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.571 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 9.6 p-10 -19.5 108.28 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 O-C-N 125.083 1.489 . . . . 4.6500000000000004 114.444 -165.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 11.0 p -127.47 -40.12 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 114.08 -1.418 . . . . 5.0 111.525 -174.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -112.16 41.92 1.88 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.325 0.583 . . . . 8.0899999999999999 109.728 177.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.497 ' HA ' ' HG2' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -144.01 25.81 1.56 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-N 115.471 -0.786 . . . . 4.29 109.403 -175.738 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.449 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 30.0 m-85 -73.82 -48.72 6.37 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.338 -0.846 . . . . 5.9800000000000004 110.769 178.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.619 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 48.3 Cg_exo -56.29 -49.97 13.5 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.732 1.621 . . . . 7.4400000000000004 112.679 170.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.619 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 63.4 Cg_exo -46.44 123.25 6.54 Favored 'Trans proline' 0 C--N 1.366 1.471 0 C-N-CA 122.407 2.072 . . . . 7.5700000000000003 112.623 169.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.8 t70 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.491 -0.766 . . . . 11.49 111.018 -175.691 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.476 0.456 0 N-CA-C 111.131 -0.373 . . . . 7.0099999999999998 111.131 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -94.32 -157.79 0.05 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 123.086 2.524 . . . . 8.0399999999999991 111.839 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.542 ' HA ' ' HG3' ' A' ' 6' ' ' GLU . 71.8 m -70.46 -13.34 62.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.824 0.345 . . . . 8.5199999999999996 111.299 178.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 94.6 t -57.9 -44.65 86.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.028 -0.533 . . . . 8.2100000000000009 111.203 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.581 ' HB2' HD23 ' A' ' 9' ' ' LEU . 5.8 p -90.26 -9.64 47.21 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.618 0.599 . . . . 4.7699999999999996 112.618 -175.179 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.542 ' HG3' ' HA ' ' A' ' 3' ' ' SER . 44.0 mt-10 -58.33 -18.5 27.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.031 0.443 . . . . 6.3700000000000001 110.667 175.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 45.3 mm -73.24 -62.12 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.784 -0.644 . . . . 6.54 111.306 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.562 ' OE1' ' HA ' ' A' ' 5' ' ' SER . 0.1 OUTLIER -102.27 -3.77 26.73 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.407 0.521 . . . . 6.54 112.407 -171.684 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.581 HD23 ' HB2' ' A' ' 5' ' ' SER . 4.2 mm? -102.39 -12.81 17.61 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.449 -0.575 . . . . 5.6799999999999997 109.449 168.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 64.2 mtt 70.78 133.47 0.03 OUTLIER 'General case' 0 C--N 1.343 0.291 0 CA-C-N 114.778 -1.101 . . . . 5.3499999999999996 112.816 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -100.9 -7.02 23.87 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.198 -0.667 . . . . 7.5599999999999996 109.198 167.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -81.84 42.3 0.7 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.383 -0.826 . . . . 5.9400000000000004 109.99 172.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -58.08 -24.03 56.96 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.662 -0.699 . . . . 5.4500000000000002 110.802 -177.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -128.23 -90.86 0.68 Allowed Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.758 -0.937 . . . . 4.8099999999999996 110.758 172.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -145.52 118.65 8.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.014 -0.736 . . . . 8.3499999999999996 109.014 172.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 69.87 -66.22 0.28 Allowed 'General case' 0 N--CA 1.471 0.594 0 O-C-N 123.481 0.488 . . . . 4.7199999999999998 110.922 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.921 ' HG ' ' H ' ' A' ' 19' ' ' SER . 6.9 tp -165.64 -72.97 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.27 -1.011 . . . . 4.8799999999999999 108.27 -177.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.564 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 7.1 m120 58.93 15.78 4.15 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.659 -0.701 . . . . 2.71 111.856 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.969 ' HA ' ' HG2' ' A' ' 22' ' ' ARG . 21.3 m -74.71 -6.02 46.47 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.935 -0.478 . . . . 5.0899999999999999 110.238 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.489 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 2.4 ptt? -94.55 -26.17 16.52 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.052 -1.092 . . . . 5.6500000000000004 108.052 171.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 59.1 mm-40 -68.39 -47.45 67.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.636 -1.165 . . . . 4.3099999999999996 109.583 172.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.969 ' HG2' ' HA ' ' A' ' 19' ' ' SER . 22.8 mmt85 -41.5 -69.74 0.13 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 114.872 -1.058 . . . . 4.6200000000000001 110.976 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.676 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 12.2 m -64.2 4.08 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.234 -0.894 . . . . 4.8300000000000001 112.836 -174.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 20' ' ' MET . 17.6 mt-10 -95.54 -52.22 4.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.267 -1.012 . . . . 5.1799999999999997 108.267 163.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 1.023 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 43.9 p-90 -71.97 -22.81 61.39 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 113.491 0.923 . . . . 3.6699999999999999 113.491 -175.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.676 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.4 mt -55.37 -31.39 61.74 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 119.294 -0.962 . . . . 4.2800000000000002 108.514 172.287 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 32' ' ' ASP . 2.5 mpt_? -110.3 -7.07 14.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 113.718 1.007 . . . . 5.96 113.718 -171.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 1.023 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 45.6 pttt -113.38 -1.96 14.09 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 119.824 -0.751 . . . . 4.7800000000000002 110.739 174.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.473 ' CG ' ' HB2' ' A' ' 25' ' ' TRP . 14.7 mmmm -124.06 -26.86 3.96 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.092 0.775 . . . . 5.96 113.092 -173.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.933 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -66.73 -42.23 86.62 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.932 0.872 . . . . 5.5 110.29 -175.093 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.933 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -172.7 21.23 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 105.723 -1.955 . . . . 4.6699999999999999 105.723 175.765 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' A' ' 27' ' ' ARG . 9.6 p-10 26.84 101.42 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 111.851 -2.432 . . . . 4.6500000000000004 113.57 -167.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.493 HG12 ' HB3' ' A' ' 27' ' ' ARG . 8.9 p -65.17 -3.28 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.363 -1.289 . . . . 5.0 110.811 -173.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -54.95 -31.46 60.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.113 -0.949 . . . . 8.0899999999999999 110.391 167.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.531 ' HB2' ' HD2' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -102.35 138.6 39.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.491 0.663 . . . . 4.29 111.07 175.87 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.676 ' C ' ' HD3' ' A' ' 38' ' ' PRO . 39.6 m-85 -107.02 -6.92 0.11 Allowed Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 114.871 1.434 . . . . 5.9800000000000004 114.871 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' A' ' 35' ' ' ASN . 45.8 Cg_endo -104.14 69.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.363 1.297 0 CA-C-N 121.908 1.717 . . . . 7.4400000000000004 114.168 171.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.676 ' HD3' ' C ' ' A' ' 36' ' ' PHE . 6.3 Cg_endo -87.37 74.42 2.58 Favored 'Trans proline' 0 N--CA 1.444 -1.383 0 C-N-CA 122.65 2.233 . . . . 7.5700000000000003 109.89 173.013 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.2 t70 . . . . . 0 C--O 1.246 0.907 0 O-C-N 124.617 1.198 . . . . 11.49 112.915 -172.465 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.473 ' CB ' ' HB ' ' A' ' 4' ' ' VAL . 3.0 Cg_exo . . . . . 0 N--CA 1.48 0.69 0 N-CA-C 110.604 -0.575 . . . . 7.0099999999999998 110.604 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.56 -60.02 0.63 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.245 2.63 . . . . 8.0399999999999991 113.038 -173.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.555 ' HA ' ' OE1' ' A' ' 6' ' ' GLU . 66.5 m -95.49 11.64 32.26 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.177 0.513 . . . . 8.5199999999999996 111.638 -177.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.473 ' HB ' ' CB ' ' A' ' 1' ' ' PRO . 72.3 t -102.27 -42.71 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.99 -0.55 . . . . 8.2100000000000009 109.756 175.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.836 ' HB3' HD23 ' A' ' 9' ' ' LEU . 33.3 m -99.41 1.1 43.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.932 -0.576 . . . . 4.7699999999999996 112.245 -177.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.555 ' OE1' ' HA ' ' A' ' 3' ' ' SER . 10.0 pt-20 -68.76 -6.11 24.61 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.108 0.48 . . . . 6.3700000000000001 111.033 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.6 mm -96.05 -47.86 12.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.092 -0.504 . . . . 6.54 111.37 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.646 ' OE1' ' HA ' ' A' ' 5' ' ' SER . 5.4 mp0 -89.06 -43.4 11.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.863 0.363 . . . . 6.54 110.186 -174.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.836 HD23 ' HB3' ' A' ' 5' ' ' SER . 3.1 mm? -90.29 -20.93 22.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.049 -0.523 . . . . 5.6799999999999997 111.783 -173.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 6' ' ' GLU . 64.6 mtt -106.46 135.33 48.14 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.451 -0.5 . . . . 5.3499999999999996 111.123 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -96.23 -4.85 41.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.663 -0.699 . . . . 7.5599999999999996 110.104 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -77.66 41.66 0.34 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.527 -0.76 . . . . 5.9400000000000004 112.602 -175.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.08 -18.93 52.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.099 0.476 . . . . 5.4500000000000002 110.599 178.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.547 ' HA3' HH22 ' A' ' 22' ' ' ARG . . . 174.08 170.91 37.95 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.421 -0.672 . . . . 4.8099999999999996 111.421 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.497 ' N ' ' HD2' ' A' ' 15' ' ' LYS . 2.0 mptt -112.95 152.96 28.75 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.712 -0.477 . . . . 8.3499999999999996 109.712 -177.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 58.0 t60 61.5 -82.8 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.58 0.55 . . . . 4.7199999999999998 111.466 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.3 tp 177.16 81.84 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.442 -1.318 . . . . 4.8799999999999999 107.442 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.712 ' HB2' HH21 ' A' ' 22' ' ' ARG . 13.2 m120 -81.66 45.63 0.9 Allowed 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.116 -0.493 . . . . 2.71 109.976 -175.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 p -65.38 -14.75 61.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.763 -0.653 . . . . 5.0899999999999999 110.943 -177.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 4.9 ptm -91.34 -24.38 19.81 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.797 -0.638 . . . . 5.6500000000000004 109.602 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.657 ' CG ' ' HB3' ' A' ' 18' ' ' ASN . 22.3 mm-40 -73.2 -52.89 12.43 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.101 -0.954 . . . . 4.3099999999999996 109.642 173.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.719 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 6.7 mmt180 -42.87 -68.7 0.17 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 113.699 -1.591 . . . . 4.6200000000000001 111.8 -174.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.689 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 m -56.55 -13.13 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 113.037 0.755 . . . . 4.8300000000000001 113.037 -171.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.99 -35.78 16.2 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.425 0.631 . . . . 5.1799999999999997 109.816 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 0.719 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 50.7 p-90 -90.32 -8.88 49.72 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 118.927 -1.109 . . . . 3.6699999999999999 113.041 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.689 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 5.5 mt -67.77 11.9 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 4.2800000000000002 112.771 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.575 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -126.49 -62.52 1.14 Allowed 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.164 -1.05 . . . . 5.96 108.164 173.187 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.661 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 52.7 pttt -61.13 -25.45 67.0 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.412 -0.813 . . . . 4.7800000000000002 113.19 -176.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.616 ' HG2' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -129.37 -17.11 3.81 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.252 0.834 . . . . 5.96 113.252 -176.961 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.06 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.3 OUTLIER -49.21 -39.9 31.59 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.12 0.486 . . . . 5.5 111.34 -172.138 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 1.06 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -167.66 -1.44 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.287 -0.869 . . . . 4.6699999999999999 110.309 173.13 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.556 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 31.8 t0 60.23 138.2 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 114.389 -1.278 . . . . 4.6500000000000004 111.566 -176.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 9.1 p -168.92 -45.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 CA-C-N 115.283 -0.871 . . . . 5.0 110.67 -171.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -132.63 29.2 4.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.81 0.814 . . . . 8.0899999999999999 109.493 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.556 ' OD1' ' HA ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -133.82 24.58 3.98 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.995 -1.002 . . . . 4.29 110.078 -174.337 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.442 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 31.6 m-85 -67.01 -47.44 52.65 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 115.323 -0.853 . . . . 5.9800000000000004 111.856 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.478 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 50.8 Cg_exo -54.87 -49.8 15.46 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 122.336 2.024 . . . . 7.4400000000000004 113.782 174.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 11.5 Cg_exo -36.79 111.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.365 1.397 0 C-N-CA 123.248 2.632 . . . . 7.5700000000000003 113.791 172.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.461 -0.781 . . . . 11.49 111.134 -176.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo . . . . . 0 N--CA 1.48 0.695 0 N-CA-C 110.668 -0.551 . . . . 7.0099999999999998 110.668 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -66.82 -72.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.985 2.456 . . . . 8.0399999999999991 112.641 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.5 m -139.93 -35.2 0.53 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 111.891 0.33 . . . . 8.5199999999999996 111.891 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 76.3 t -49.98 -40.13 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.825 0.345 . . . . 8.2100000000000009 111.51 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.3 m -136.13 62.54 1.61 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.746 0.308 . . . . 4.7699999999999996 111.11 174.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.808 ' HG3' ' H ' ' A' ' 7' ' ' ILE . 8.6 pt-20 -81.01 -74.65 0.31 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 120.734 -0.387 . . . . 6.3700000000000001 110.801 172.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.808 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 29.5 mm -113.54 63.26 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.267 0.556 . . . . 6.54 110.269 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -139.99 -63.02 0.5 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.875 -0.602 . . . . 6.54 110.277 -178.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 9' ' ' LEU . 1.7 pt? -50.21 -30.79 12.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.342 -0.844 . . . . 5.6799999999999997 112.37 175.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.401 ' H ' HD23 ' A' ' 9' ' ' LEU . 65.8 mtt -75.99 75.72 2.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.981 0.42 . . . . 5.3499999999999996 110.862 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -77.16 -13.86 59.88 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.666 -0.494 . . . . 7.5599999999999996 109.666 175.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -65.2 -22.63 66.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.482 -0.781 . . . . 5.9400000000000004 110.214 173.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 42.06 55.34 3.87 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 124.319 1.012 . . . . 5.4500000000000002 113.112 172.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.59 -108.21 0.24 Allowed Glycine 0 N--CA 1.444 -0.83 0 C-N-CA 120.644 -0.789 . . . . 4.8099999999999996 112.29 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -132.05 101.24 5.33 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.719 0.295 . . . . 8.3499999999999996 110.411 -175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 49.98 -118.89 1.22 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.681 -0.691 . . . . 4.7199999999999998 111.121 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.53 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 23.0 tp -135.17 68.18 1.47 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.55 -0.907 . . . . 4.8799999999999999 108.55 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.758 ' O ' ' HD3' ' A' ' 22' ' ' ARG . 98.1 m-20 -84.49 40.35 0.78 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.479 -0.782 . . . . 2.71 110.687 -178.48 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.8 m -75.69 3.88 8.86 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.545 0.212 . . . . 5.0899999999999999 111.523 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.683 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.9 ptm -99.49 -36.58 9.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 107.912 -1.144 . . . . 5.6500000000000004 107.912 168.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 22.5 mm-40 -65.42 -56.48 12.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.787 -1.097 . . . . 4.3099999999999996 110.23 176.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.764 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -43.0 -66.39 0.38 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.484 -1.235 . . . . 4.6200000000000001 111.874 -177.138 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.761 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.1 m -61.24 -9.48 2.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 112.469 0.544 . . . . 4.8300000000000001 112.469 -173.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' A' ' 20' ' ' MET . 25.9 mt-10 -83.63 -55.71 4.13 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.477 -0.934 . . . . 5.1799999999999997 108.477 168.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TRP . . . . . 1.048 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 p-90 -70.09 -19.67 63.25 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 113.609 0.966 . . . . 3.6699999999999999 113.609 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.761 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.2 mt -48.81 -34.21 11.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 120.119 -0.632 . . . . 4.2800000000000002 109.785 173.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.5 mpt_? -101.59 -25.13 13.99 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.19 -0.913 . . . . 5.96 112.285 -171.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 1.048 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.1 pttt -98.48 3.33 48.23 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.814 -0.354 . . . . 4.7800000000000002 111.325 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.628 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 75.0 mmtt -122.39 -31.96 3.71 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.241 0.46 . . . . 5.96 112.241 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.74 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -63.87 -36.67 84.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 121.254 0.549 . . . . 5.5 110.531 -175.39 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.74 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -161.69 32.03 0.13 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.127 -0.942 . . . . 4.6699999999999999 108.877 170.297 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.441 ' O ' ' HB ' ' A' ' 33' ' ' VAL . 6.0 p-10 38.08 -149.37 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 113.751 -1.568 . . . . 4.6500000000000004 111.974 -175.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.464 ' O ' ' HB2' ' A' ' 34' ' ' HIS . 54.1 t 71.84 -14.8 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 N-CA-C 112.382 0.512 . . . . 5.0 112.382 172.249 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 33' ' ' VAL . 50.2 m80 72.82 18.41 4.13 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.163 0.585 . . . . 8.0899999999999999 109.778 -174.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 67.56 96.28 0.06 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 114.714 -1.13 . . . . 4.29 112.073 177.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.474 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 2.8 m-85 -114.17 -50.93 0.05 OUTLIER Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 114.824 -1.08 . . . . 5.9800000000000004 110.698 176.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.568 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 51.2 Cg_exo -56.27 -48.08 21.12 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 121.868 1.712 . . . . 7.4400000000000004 112.713 170.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 2.7 Cg_exo -77.68 141.79 19.87 Favored 'Trans proline' 0 C--N 1.356 0.965 0 C-N-CA 122.025 1.816 . . . . 7.5700000000000003 111.18 171.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.367 -0.825 . . . . 11.49 111.31 -176.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.794 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--O 1.22 -0.493 0 N-CA-C 112.194 0.442 . . . . 2.71 112.194 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.6 t -59.9 -18.9 48.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.007 0.432 . . . . 5.09 110.214 175.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.473 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.9 ptp -85.64 -24.62 27.01 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.933 -0.576 . . . . 5.65 109.569 176.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.683 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 9.5 mm-40 -75.67 -52.66 10.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.178 -0.919 . . . . 4.31 109.74 176.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.808 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.8 mpt_? -48.33 -64.78 0.7 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.127 -0.942 . . . . 4.62 111.808 -174.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.613 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 15.9 m -53.05 -18.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.902 0.751 . . . . 4.83 112.138 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.525 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 16.8 mm-40 -89.07 -47.97 7.73 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.218 0.532 . . . . 5.18 110.335 177.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.808 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 30.6 p-90 -71.59 -15.53 62.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 118.284 -1.366 . . . . 3.67 112.675 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.613 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.3 mt -46.75 -39.52 11.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 120.228 -0.589 . . . . 4.28 110.493 173.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.525 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -92.66 -9.28 41.45 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.37 -0.832 . . . . 5.96 111.308 -167.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.726 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 62.2 pttt -115.25 7.54 15.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.093 -0.503 . . . . 4.78 110.439 173.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.434 ' HD3' ' O ' ' A' ' 28' ' ' LYS . 33.3 mmtp -136.1 -37.54 0.72 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.891 1.071 . . . . 5.96 113.891 -178.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -48.76 -49.05 40.27 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 122.033 0.92 . . . . 5.5 109.696 -172.472 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.785 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -156.99 17.94 0.3 Allowed 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.167 -2.16 . . . . 4.67 105.167 163.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.557 ' HB2' ' C ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER . . . . . 0 CA--C 1.508 -0.637 0 CA-C-N 111.291 -2.686 . . . . 4.65 112.57 -166.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.784 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 11.3 m120 . . . . . 0 C--O 1.222 -0.365 0 N-CA-C 112.948 0.721 . . . . 2.71 112.948 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.513 ' HA ' ' CD ' ' A' ' 22' ' ' ARG . 74.4 m -71.44 2.11 5.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.817 0.341 . . . . 5.09 111.539 178.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.29 -7.3 26.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.226 -1.027 . . . . 5.65 108.226 171.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 48.6 mm-40 -96.43 -46.66 6.29 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.976 -1.465 . . . . 4.31 109.22 173.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.794 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.6 mpt_? -46.47 -65.75 0.51 Allowed 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 115.322 -0.853 . . . . 4.62 111.754 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.991 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -57.41 -13.37 2.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 O-C-N 123.443 0.464 . . . . 4.83 111.809 -174.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.507 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 7.3 mm-40 -92.45 -33.34 14.56 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.382 0.611 . . . . 5.18 110.14 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.918 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 33.6 p-90 -83.99 -11.15 57.24 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 118.126 -1.43 . . . . 3.67 111.809 172.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.991 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.5 mt -62.24 -6.15 2.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.154 0.427 . . . . 4.28 112.154 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.507 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -110.01 -42.33 4.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.347 -0.388 . . . . 5.96 110.803 176.206 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.918 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 60.8 pttt -80.96 -21.27 40.51 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 111.758 0.281 . . . . 4.78 111.758 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 11.7 mmpt? -101.23 -23.79 14.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.843 0.354 . . . . 5.96 110.665 176.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.005 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 38.4 tp -52.13 -59.53 4.27 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.492 -0.776 . . . . 5.5 111.315 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 1.005 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -164.09 22.23 0.07 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.589 -1.187 . . . . 4.67 108.728 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.653 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 3.6 p30 . . . . . 0 N--CA 1.468 0.426 0 O-C-N 125.305 1.628 . . . . 4.65 115.274 -172.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.688 ' HB3' ' HG3' ' A' ' 21' ' ' GLU . 10.9 m120 . . . . . 0 N--CA 1.439 -1.023 0 N-CA-C 108.623 -0.88 . . . . 2.71 108.623 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.7 p -64.03 -5.83 5.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.929 -1.032 . . . . 5.09 111.63 -175.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -90.82 -28.64 18.06 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.048 -0.723 . . . . 5.65 109.048 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.688 ' HG3' ' HB3' ' A' ' 18' ' ' ASN . 30.3 mt-10 -71.02 -56.4 6.23 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.597 -1.183 . . . . 4.31 109.133 171.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.845 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 1.4 mmt180 -46.6 -69.63 0.12 Allowed 'General case' 0 CA--C 1.508 -0.671 0 CA-C-N 112.786 -2.006 . . . . 4.62 113.165 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.729 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -55.97 -15.19 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 124.091 0.869 . . . . 4.83 112.221 -168.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 11.5 mt-10 -89.74 -45.55 9.22 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.072 0.463 . . . . 5.18 110.123 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.845 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 35.2 p-90 -74.6 -17.11 60.76 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 118.612 -1.235 . . . . 3.67 112.391 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.729 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.7 mt -47.68 -30.74 4.01 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.233 0.539 . . . . 4.28 111.244 175.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -99.37 -33.21 10.8 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.534 -0.757 . . . . 5.96 111.469 -171.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.808 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 58.9 pttt -88.08 -0.8 57.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.942 0.401 . . . . 4.78 110.762 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.491 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 31.6 mmmt -116.96 -28.92 6.14 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.165 0.431 . . . . 5.96 112.165 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.909 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -69.27 -35.5 76.14 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-O 121.437 0.637 . . . . 5.5 110.328 -173.779 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.909 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -158.73 16.4 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.013 -0.994 . . . . 4.67 109.303 175.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.563 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 4.7 p-10 . . . . . 0 N--CA 1.472 0.64 0 O-C-N 125.41 1.694 . . . . 4.65 112.626 -167.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.64 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 8.1 m120 . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 120.757 0.313 . . . . 2.71 110.36 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.3 t -67.87 -5.5 17.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.403 -0.362 . . . . 5.09 110.31 -178.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.3 ptm -99.94 -16.97 17.79 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 122.309 1.052 . . . . 5.65 108.511 178.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 58.9 mt-10 -84.69 -59.51 2.34 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.184 -1.825 . . . . 4.31 110.009 175.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.807 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 3.5 mpt_? -48.31 -62.65 1.38 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 115.122 -0.945 . . . . 4.62 112.521 -176.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.792 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.6 m -60.67 -6.94 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 123.783 0.677 . . . . 4.83 112.471 -166.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -94.73 -41.87 9.04 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.35 -0.611 . . . . 5.18 109.35 175.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.807 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 40.6 p-90 -80.78 -16.71 53.07 Favored 'General case' 0 CA--C 1.504 -0.819 0 C-N-CA 118.935 -1.106 . . . . 3.67 112.834 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.792 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.8 mt -49.43 -31.12 9.09 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 120.87 0.366 . . . . 4.28 111.317 176.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.748 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.85 -37.55 9.39 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.036 0.446 . . . . 5.96 110.952 -170.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.758 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -84.08 1.92 41.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.179 -0.464 . . . . 4.78 111.373 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.55 ' HD2' ' O ' ' A' ' 28' ' ' LYS . 13.9 mmmm -128.28 -24.55 3.09 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 112.964 0.727 . . . . 5.96 112.964 179.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.748 HD23 ' HA ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -59.8 -36.47 76.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.039 0.923 . . . . 5.5 109.471 -175.181 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.575 HE21 ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -159.22 5.73 0.1 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.685 -1.598 . . . . 4.67 107.347 169.567 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.551 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.536 0 CA-C-N 113.32 -1.764 . . . . 4.65 111.814 -166.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.807 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 11.8 m120 . . . . . 0 N--CA 1.449 -0.516 0 CA-C-O 119.651 -0.214 . . . . 2.71 110.479 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.485 ' H ' ' CD ' ' A' ' 22' ' ' ARG . 22.7 t 62.19 -53.91 0.14 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.007 0.817 . . . . 5.09 111.672 -174.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.435 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.7 ptp -77.75 -27.26 50.38 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 108.022 -1.103 . . . . 5.65 108.022 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.807 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 49.0 mt-10 -80.36 -46.03 16.76 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 113.418 -1.719 . . . . 4.31 110.963 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.802 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.7 OUTLIER -48.83 -63.14 1.18 Allowed 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 123.566 0.541 . . . . 4.62 111.147 179.595 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.788 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 30.8 m -64.22 3.62 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 115.554 -0.748 . . . . 4.83 112.376 -169.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 20' ' ' MET . 10.8 mt-10 -100.31 -45.54 5.56 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.104 -0.702 . . . . 5.18 109.104 169.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.887 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 42.7 p-90 -77.79 -18.9 55.9 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 119.494 -0.883 . . . . 3.67 112.726 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.788 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.0 mt -50.35 -28.12 7.42 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 121.126 0.488 . . . . 4.28 111.099 176.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.802 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -103.15 -42.79 5.66 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.592 -0.731 . . . . 5.96 111.0 -172.217 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.887 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.5 pttt -78.32 -5.57 52.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.577 -0.283 . . . . 4.78 111.378 -177.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.437 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 14.1 mmmm -114.87 -34.33 5.15 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.6 -0.44 . . . . 5.96 112.009 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.941 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -57.64 -38.72 75.51 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.948 0.404 . . . . 5.5 110.96 -175.12 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.941 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -159.2 23.17 0.2 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.611 -0.722 . . . . 4.67 109.428 175.678 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 CA--C 1.515 -0.377 0 CA-C-N 113.906 -1.497 . . . . 4.65 112.229 -167.68 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.66 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 21.6 m120 . . . . . 0 CA--C 1.506 -0.743 0 CA-C-O 121.074 0.464 . . . . 2.71 111.47 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.9 t -61.89 -32.49 72.86 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.5 -0.773 . . . . 5.09 109.066 177.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.783 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 27.9 ptm -76.01 -45.45 34.48 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.863 -0.608 . . . . 5.65 110.085 178.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.66 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 5.9 mp0 -48.71 -57.95 5.51 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.389 0.614 . . . . 4.31 109.736 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.704 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -53.19 -64.33 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.33 -1.305 . . . . 4.62 111.945 177.541 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.896 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 10.6 p -55.01 -19.38 4.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 123.587 0.554 . . . . 4.83 111.773 -172.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.783 ' HG2' ' O ' ' A' ' 20' ' ' MET . 8.7 mm-40 -75.04 -58.73 3.1 Favored 'General case' 0 CA--C 1.504 -0.815 0 O-C-N 121.612 -0.68 . . . . 5.18 109.255 169.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.76 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 29.6 p-90 -69.27 -14.09 62.76 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 113.784 1.031 . . . . 3.67 113.784 -174.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.896 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.6 mt -49.68 -42.21 44.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.275 1.036 . . . . 4.28 108.253 170.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.612 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.3 mpt_? -99.16 22.39 10.5 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.569 -1.196 . . . . 5.96 111.493 -170.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.76 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 55.9 pttt -131.81 -21.79 2.42 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.133 -0.485 . . . . 4.78 111.017 162.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.638 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -160.62 19.32 0.14 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 115.063 1.505 . . . . 5.96 115.063 -175.206 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.973 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -62.48 -42.61 99.6 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.522 1.056 . . . . 5.5 109.334 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.973 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -163.77 102.36 0.9 Allowed 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.125 -2.176 . . . . 4.67 105.125 169.305 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 C--N 1.318 -0.789 0 CA-C-O 122.587 1.184 . . . . 4.65 111.857 -168.194 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.711 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 10.5 m120 . . . . . 0 N--CA 1.439 -0.976 0 CA-C-O 121.49 0.662 . . . . 2.71 109.832 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.3 m -69.16 -3.89 15.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.944 -1.026 . . . . 5.09 110.82 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 22.3 ptt? -95.24 -22.64 17.67 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.176 -1.046 . . . . 5.65 108.176 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -85.93 -52.66 5.58 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.394 -1.73 . . . . 4.31 109.854 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.887 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -45.04 -63.45 0.92 Allowed 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.99 -1.004 . . . . 4.62 111.82 -178.544 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.8 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.3 m -62.55 -3.34 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.877 -0.602 . . . . 4.83 112.336 -169.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 9.0 mm-40 -96.6 -44.79 6.99 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.586 0.708 . . . . 5.18 109.496 172.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.887 ' CZ2' ' HG3' ' A' ' 22' ' ' ARG . 42.6 p-90 -77.66 -18.11 57.03 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 118.853 -1.139 . . . . 3.67 112.95 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.8 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.5 mt -48.46 -33.41 9.31 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 121.072 0.463 . . . . 4.28 110.935 175.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.589 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.81 -35.82 10.0 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.433 -0.803 . . . . 5.96 111.156 -170.473 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.861 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -85.69 -7.01 59.05 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.679 -0.408 . . . . 4.78 111.651 -177.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 30.0 mmmt -118.95 -9.47 10.07 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 119.931 -0.708 . . . . 5.96 112.21 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.711 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -87.45 -36.11 17.88 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 119.94 -0.704 . . . . 5.5 110.082 -178.699 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.711 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -176.98 42.53 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.597 -0.729 . . . . 4.67 109.589 176.165 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.571 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 9.6 p-10 . . . . . 0 N--CA 1.471 0.603 0 O-C-N 125.083 1.489 . . . . 4.65 114.444 -165.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.564 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 7.1 m120 . . . . . 0 C--O 1.22 -0.483 0 N-CA-C 111.856 0.317 . . . . 2.71 111.856 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.969 ' HA ' ' HG2' ' A' ' 22' ' ' ARG . 21.3 m -74.71 -6.02 46.47 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.935 -0.478 . . . . 5.09 110.238 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.489 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 2.4 ptt? -94.55 -26.17 16.52 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.052 -1.092 . . . . 5.65 108.052 171.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 59.1 mm-40 -68.39 -47.45 67.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.636 -1.165 . . . . 4.31 109.583 172.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.969 ' HG2' ' HA ' ' A' ' 19' ' ' SER . 22.8 mmt85 -41.5 -69.74 0.13 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 114.872 -1.058 . . . . 4.62 110.976 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.676 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 12.2 m -64.2 4.08 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.234 -0.894 . . . . 4.83 112.836 -174.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 20' ' ' MET . 17.6 mt-10 -95.54 -52.22 4.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.267 -1.012 . . . . 5.18 108.267 163.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 1.023 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 43.9 p-90 -71.97 -22.81 61.39 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 113.491 0.923 . . . . 3.67 113.491 -175.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.676 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.4 mt -55.37 -31.39 61.74 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 119.294 -0.962 . . . . 4.28 108.514 172.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 32' ' ' ASP . 2.5 mpt_? -110.3 -7.07 14.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 113.718 1.007 . . . . 5.96 113.718 -171.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 1.023 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 45.6 pttt -113.38 -1.96 14.09 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 119.824 -0.751 . . . . 4.78 110.739 174.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.473 ' CG ' ' HB2' ' A' ' 25' ' ' TRP . 14.7 mmmm -124.06 -26.86 3.96 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.092 0.775 . . . . 5.96 113.092 -173.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.933 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -66.73 -42.23 86.62 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.932 0.872 . . . . 5.5 110.29 -175.093 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.933 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -172.7 21.23 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 105.723 -1.955 . . . . 4.67 105.723 175.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' A' ' 27' ' ' ARG . 9.6 p-10 . . . . . 0 C--O 1.214 -0.779 0 CA-C-N 111.851 -2.432 . . . . 4.65 113.57 -167.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.712 ' HB2' HH21 ' A' ' 22' ' ' ARG . 13.2 m120 . . . . . 0 N--CA 1.447 -0.601 0 N-CA-C 109.976 -0.379 . . . . 2.71 109.976 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 p -65.38 -14.75 61.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.763 -0.653 . . . . 5.09 110.943 -177.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 4.9 ptm -91.34 -24.38 19.81 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.797 -0.638 . . . . 5.65 109.602 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.657 ' CG ' ' HB3' ' A' ' 18' ' ' ASN . 22.3 mm-40 -73.2 -52.89 12.43 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.101 -0.954 . . . . 4.31 109.642 173.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.719 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 6.7 mmt180 -42.87 -68.7 0.17 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 113.699 -1.591 . . . . 4.62 111.8 -174.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.689 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 m -56.55 -13.13 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 113.037 0.755 . . . . 4.83 113.037 -171.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.99 -35.78 16.2 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.425 0.631 . . . . 5.18 109.816 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 0.719 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 50.7 p-90 -90.32 -8.88 49.72 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 118.927 -1.109 . . . . 3.67 113.041 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.689 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 5.5 mt -67.77 11.9 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 4.28 112.771 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.575 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -126.49 -62.52 1.14 Allowed 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.164 -1.05 . . . . 5.96 108.164 173.187 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.661 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 52.7 pttt -61.13 -25.45 67.0 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.412 -0.813 . . . . 4.78 113.19 -176.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.616 ' HG2' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -129.37 -17.11 3.81 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.252 0.834 . . . . 5.96 113.252 -176.961 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.06 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.3 OUTLIER -49.21 -39.9 31.59 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.12 0.486 . . . . 5.5 111.34 -172.138 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 1.06 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -167.66 -1.44 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.287 -0.869 . . . . 4.67 110.309 173.13 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.413 ' H ' ' H ' ' A' ' 31' ' ' GLN . 31.8 t0 . . . . . 0 N--CA 1.462 0.132 0 CA-C-N 114.389 -1.278 . . . . 4.65 111.566 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.758 ' O ' ' HD3' ' A' ' 22' ' ' ARG . 10.6 m120 . . . . . 0 C--O 1.222 -0.376 0 CA-C-O 120.75 0.31 . . . . 2.71 110.687 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.8 m -75.69 3.88 8.86 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.545 0.212 . . . . 5.09 111.523 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.683 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.9 ptm -99.49 -36.58 9.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 107.912 -1.144 . . . . 5.65 107.912 168.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 22.5 mm-40 -65.42 -56.48 12.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.787 -1.097 . . . . 4.31 110.23 176.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.764 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -43.0 -66.39 0.38 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.484 -1.235 . . . . 4.62 111.874 -177.138 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.761 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.1 m -61.24 -9.48 2.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 112.469 0.544 . . . . 4.83 112.469 -173.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' A' ' 20' ' ' MET . 25.9 mt-10 -83.63 -55.71 4.13 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.477 -0.934 . . . . 5.18 108.477 168.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . 1.048 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 p-90 -70.09 -19.67 63.25 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 113.609 0.966 . . . . 3.67 113.609 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.761 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.2 mt -48.81 -34.21 11.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 120.119 -0.632 . . . . 4.28 109.785 173.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.5 mpt_? -101.59 -25.13 13.99 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.19 -0.913 . . . . 5.96 112.285 -171.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 1.048 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.1 pttt -98.48 3.33 48.23 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.814 -0.354 . . . . 4.78 111.325 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.628 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 75.0 mmtt -122.39 -31.96 3.71 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.241 0.46 . . . . 5.96 112.241 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.74 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -63.87 -36.67 84.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 121.254 0.549 . . . . 5.5 110.531 -175.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.74 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -161.69 32.03 0.13 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.127 -0.942 . . . . 4.67 108.877 170.297 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.429 ' HA ' ' C ' ' A' ' 28' ' ' LYS . 6.0 p-10 . . . . . 0 N--CA 1.47 0.541 0 CA-C-N 113.751 -1.568 . . . . 4.65 111.974 -175.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.476 ' HB3' ' HG ' ' A' ' 9' ' ' LEU . 3.9 Cg_endo . . . . . 0 N--CA 1.478 0.58 0 N-CA-C 110.8 -0.5 . . . . 7.01 110.8 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -88.79 -151.12 0.04 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.909 0 C-N-CA 123.219 2.613 . . . . 8.04 111.98 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.49 ' O ' ' HG2' ' A' ' 6' ' ' GLU . 17.1 m -65.43 -23.05 66.84 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.047 0.388 . . . . 8.52 112.047 -175.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.0 p -70.33 -22.68 24.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-O 121.026 0.441 . . . . 8.21 111.393 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.808 ' HB2' HD23 ' A' ' 9' ' ' LEU . 4.0 p -126.55 21.79 7.08 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.879 0.326 . . . . 4.77 111.879 -177.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.573 ' O ' ' HB2' ' A' ' 10' ' ' MET . 7.9 pt-20 -74.6 2.19 10.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.96 0.409 . . . . 6.37 110.912 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.4 mm -99.17 -57.36 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.3 0.571 . . . . 6.54 110.326 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.521 ' HG2' HD22 ' A' ' 9' ' ' LEU . 18.3 pm0 -85.69 -32.17 22.1 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.427 -0.806 . . . . 6.54 111.586 -175.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.808 HD23 ' HB2' ' A' ' 5' ' ' SER . 4.3 mm? -87.49 -29.57 21.28 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.685 -0.406 . . . . 5.68 110.691 177.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.739 ' SD ' ' HE3' ' A' ' 15' ' ' LYS . 67.5 mtt -109.72 104.82 13.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.834 0.35 . . . . 5.35 110.862 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -100.79 -16.11 17.41 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.395 -0.595 . . . . 7.56 109.395 175.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -58.65 -39.09 79.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.812 -1.085 . . . . 5.94 109.273 170.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.415 HH21 ' HG3' ' A' ' 21' ' ' GLU . 27.3 mmm180 54.7 -154.65 0.27 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.341 -0.845 . . . . 5.45 111.814 172.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' H ' ' HB3' ' A' ' 13' ' ' ARG . . . 63.02 51.26 56.7 Favored Glycine 0 C--O 1.227 -0.337 0 N-CA-C 110.554 -1.018 . . . . 4.81 110.554 -174.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.739 ' HE3' ' SD ' ' A' ' 10' ' ' MET . 71.1 mmtt -101.07 -12.45 18.82 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 113.12 0.785 . . . . 8.35 113.12 -167.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -147.56 -80.93 0.14 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.432 -1.321 . . . . 4.72 107.432 175.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.456 ' C ' ' H ' ' A' ' 19' ' ' SER . 13.7 tp -125.0 -45.45 1.87 Allowed 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.803 -1.09 . . . . 4.88 109.699 170.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.794 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 0.9 OUTLIER 69.25 -22.28 0.15 Allowed 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 115.383 -0.826 . . . . 2.71 112.194 174.79 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.456 ' H ' ' C ' ' A' ' 17' ' ' LEU . 8.6 t -59.9 -18.9 48.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.007 0.432 . . . . 5.09 110.214 175.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.473 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.9 ptp -85.64 -24.62 27.01 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.933 -0.576 . . . . 5.65 109.569 176.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.683 ' HG2' ' HA ' ' A' ' 18' ' ' ASN . 9.5 mm-40 -75.67 -52.66 10.02 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.178 -0.919 . . . . 4.31 109.74 176.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.808 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.8 mpt_? -48.33 -64.78 0.7 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.127 -0.942 . . . . 4.62 111.808 -174.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.613 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 15.9 m -53.05 -18.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.902 0.751 . . . . 4.83 112.138 -174.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.525 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 16.8 mm-40 -89.07 -47.97 7.73 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.218 0.532 . . . . 5.18 110.335 177.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.808 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 30.6 p-90 -71.59 -15.53 62.26 Favored 'General case' 0 CA--C 1.496 -1.103 0 C-N-CA 118.284 -1.366 . . . . 3.67 112.675 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.613 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.3 mt -46.75 -39.52 11.82 Favored 'General case' 0 N--CA 1.438 -1.07 0 C-N-CA 120.228 -0.589 . . . . 4.28 110.493 173.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.525 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -92.66 -9.28 41.45 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.37 -0.832 . . . . 5.96 111.308 -167.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.726 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 62.2 pttt -115.25 7.54 15.26 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.093 -0.503 . . . . 4.78 110.439 173.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.434 ' HD3' ' O ' ' A' ' 28' ' ' LYS . 33.3 mmtp -136.1 -37.54 0.72 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.891 1.071 . . . . 5.96 113.891 -178.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -48.76 -49.05 40.27 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 122.033 0.92 . . . . 5.5 109.696 -172.472 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.835 HE22 ' HA ' ' A' ' 33' ' ' VAL . 1.0 OUTLIER -156.99 17.94 0.3 Allowed 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 105.167 -2.16 . . . . 4.67 105.167 163.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.557 ' HB2' ' C ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 38.8 107.91 0.0 OUTLIER 'General case' 0 CA--C 1.508 -0.637 0 CA-C-N 111.291 -2.686 . . . . 4.65 112.57 -166.072 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.835 ' HA ' HE22 ' A' ' 31' ' ' GLN . 5.0 p -71.37 -9.24 12.6 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.35 0 CA-C-N 112.549 -2.114 . . . . 5.0 111.232 -166.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -66.59 -9.47 35.71 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.056 -0.52 . . . . 8.09 111.765 175.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -78.79 5.8 10.48 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.358 0.503 . . . . 4.29 112.358 -175.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.442 ' CB ' ' HD3' ' A' ' 37' ' ' PRO . 3.2 m-85 -57.17 -57.93 21.4 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 120.738 -0.385 . . . . 5.98 110.933 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.656 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 27.4 Cg_exo -63.18 -52.76 1.86 Allowed 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 121.482 1.455 . . . . 7.44 112.796 168.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 46.0 Cg_exo -64.34 38.86 0.1 Allowed 'Trans proline' 0 C--N 1.367 1.546 0 C-N-CA 123.749 2.966 . . . . 7.57 115.063 174.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.3 t70 . . . . . 0 C--O 1.245 0.838 0 CA-C-O 118.498 -0.763 . . . . 11.49 109.97 176.986 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.48 0.71 0 N-CA-C 111.283 -0.314 . . . . 7.01 111.283 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -71.95 -64.61 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.828 2.352 . . . . 8.04 112.036 177.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 67.1 m -121.3 27.47 8.33 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.36 0.6 . . . . 8.52 110.337 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.8 t -79.64 -66.34 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.731 -0.668 . . . . 8.21 110.708 -179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.85 ' HB2' ' HB2' ' A' ' 9' ' ' LEU . 13.2 p -92.59 -15.67 26.61 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.303 -0.408 . . . . 4.77 112.035 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -66.12 16.87 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.236 0.828 . . . . 6.37 113.236 -174.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.461 ' H ' ' C ' ' A' ' 5' ' ' SER . 28.4 mm -107.66 -46.22 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 CA-C-O 120.739 0.304 . . . . 6.54 110.659 175.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.639 HE21 ' HG ' ' A' ' 9' ' ' LEU . 5.4 pm0 -113.12 -23.42 10.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.511 0.672 . . . . 6.54 109.622 -177.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.85 ' HB2' ' HB2' ' A' ' 5' ' ' SER . 54.1 mt -110.14 27.59 9.46 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.161 -0.927 . . . . 5.68 109.871 177.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 63.8 mtt -33.59 109.39 0.07 Allowed 'General case' 0 C--N 1.346 0.446 0 O-C-N 123.716 0.635 . . . . 5.35 111.342 170.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -80.22 11.93 3.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.314 0.578 . . . . 7.56 110.608 -178.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 32.1 p30 -74.1 -12.37 60.58 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.67 -0.695 . . . . 5.94 110.955 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 13' ' ' ARG . 6.6 mpt_? -65.71 -31.26 72.16 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.366 -0.379 . . . . 5.45 110.756 175.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -151.82 101.87 0.22 Allowed Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.952 -0.642 . . . . 4.81 112.034 -177.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.429 ' HE2' ' HB2' ' A' ' 15' ' ' LYS . 14.0 ptmm? -125.67 -0.08 7.45 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.066 0.46 . . . . 8.35 110.595 177.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -158.63 -133.14 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.292 -1.003 . . . . 4.72 108.292 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.34 -64.05 1.03 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.73 -0.47 . . . . 4.88 109.73 175.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.784 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 11.3 m120 69.32 -17.24 0.22 Allowed 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 115.426 -0.806 . . . . 2.71 112.948 169.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.513 ' HA ' ' CD ' ' A' ' 22' ' ' ARG . 74.4 m -71.44 2.11 5.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.817 0.341 . . . . 5.09 111.539 178.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.29 -7.3 26.54 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.226 -1.027 . . . . 5.65 108.226 171.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 48.6 mm-40 -96.43 -46.66 6.29 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.976 -1.465 . . . . 4.31 109.22 173.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.794 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 2.6 mpt_? -46.47 -65.75 0.51 Allowed 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 115.322 -0.853 . . . . 4.62 111.754 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.991 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -57.41 -13.37 2.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 O-C-N 123.443 0.464 . . . . 4.83 111.809 -174.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.507 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 7.3 mm-40 -92.45 -33.34 14.56 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.382 0.611 . . . . 5.18 110.14 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.918 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 33.6 p-90 -83.99 -11.15 57.24 Favored 'General case' 0 N--CA 1.436 -1.143 0 C-N-CA 118.126 -1.43 . . . . 3.67 111.809 172.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.991 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.5 mt -62.24 -6.15 2.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.154 0.427 . . . . 4.28 112.154 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.507 ' CZ ' ' HA ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -110.01 -42.33 4.23 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.347 -0.388 . . . . 5.96 110.803 176.206 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.918 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 60.8 pttt -80.96 -21.27 40.51 Favored 'General case' 0 C--O 1.225 -0.212 0 N-CA-C 111.758 0.281 . . . . 4.78 111.758 -175.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 11.7 mmpt? -101.23 -23.79 14.36 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.843 0.354 . . . . 5.96 110.665 176.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.005 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 38.4 tp -52.13 -59.53 4.27 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.492 -0.776 . . . . 5.5 111.315 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 1.005 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -164.09 22.23 0.07 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.589 -1.187 . . . . 4.67 108.728 179.482 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.936 ' HA ' HD21 ' A' ' 35' ' ' ASN . 3.6 p30 13.66 97.95 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 O-C-N 125.305 1.628 . . . . 4.65 115.274 -172.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 31' ' ' GLN . 55.4 t -139.68 -55.48 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 113.734 -1.575 . . . . 5.0 111.14 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -93.83 34.53 1.21 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.688 0.756 . . . . 8.09 109.007 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.936 HD21 ' HA ' ' A' ' 32' ' ' ASP . 0.4 OUTLIER -172.11 62.0 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.839 -1.073 . . . . 4.29 110.678 -167.721 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.557 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 36.6 m-85 -81.49 -47.28 1.07 Allowed Pre-proline 0 C--N 1.317 -0.809 0 N-CA-C 112.14 0.422 . . . . 5.98 112.14 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.557 ' HD2' ' N ' ' A' ' 36' ' ' PHE . 7.9 Cg_exo -41.64 -46.51 6.26 Favored 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 123.068 2.512 . . . . 7.44 114.937 175.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -49.51 105.01 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.28 0 C-N-CA 122.572 2.181 . . . . 7.57 113.531 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.5 t70 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.158 -0.925 . . . . 11.49 111.119 178.568 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.632 ' HB2' ' CG1' ' A' ' 4' ' ' VAL . 56.9 Cg_exo . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 119.803 -0.165 . . . . 7.01 111.902 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.5 ' HD2' ' HB3' ' A' ' 1' ' ' PRO . 75.5 Cg_exo -17.97 -78.97 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.028 1 C-N-CA 126.187 4.592 . . . . 8.04 115.181 -166.013 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.418 ' H ' ' HB2' ' A' ' 2' ' ' PRO . 3.9 t -128.49 -6.04 5.28 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.036 0.446 . . . . 8.52 110.148 178.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.632 ' CG1' ' HB2' ' A' ' 1' ' ' PRO . 12.2 p -73.0 -39.48 57.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.151 -0.477 . . . . 8.21 111.94 -177.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.626 ' HB2' ' HG ' ' A' ' 9' ' ' LEU . 32.6 p -70.07 -20.81 63.2 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 119.905 -0.718 . . . . 4.77 112.003 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -64.53 -9.86 21.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.051 0.453 . . . . 6.37 111.152 -175.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 mp -89.21 -42.91 14.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.024 -0.535 . . . . 6.54 110.599 177.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.423 HE21 ' HB2' ' A' ' 8' ' ' GLN . 1.8 mp0 -89.25 -39.89 13.21 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 120.664 -0.415 . . . . 6.54 110.412 -174.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.626 ' HG ' ' HB2' ' A' ' 5' ' ' SER . 8.7 mt -74.86 -28.23 60.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.911 0.386 . . . . 5.68 110.256 -178.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 62.0 mtt -123.82 86.28 2.55 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.358 -0.383 . . . . 5.35 111.449 -177.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.46 ' C ' ' H ' ' A' ' 13' ' ' ARG . 72.5 m-70 -91.29 -5.72 54.26 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.023 -0.732 . . . . 7.56 109.023 171.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -75.46 39.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.031 -0.986 . . . . 5.94 109.957 170.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.46 ' H ' ' C ' ' A' ' 11' ' ' HIS . 29.2 mmm180 -46.98 -55.6 7.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.701 -1.136 . . . . 5.45 112.181 -171.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.521 ' HA3' HD21 ' A' ' 18' ' ' ASN . . . -167.59 -48.49 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.218 -0.992 . . . . 4.81 112.583 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 14' ' ' GLY . 56.0 mtpt 75.84 -39.82 0.39 Allowed 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.431 0.692 . . . . 8.35 111.533 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -50.29 -82.95 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.467 0.651 . . . . 4.72 111.781 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 19.8 tp -152.03 82.1 1.26 Allowed 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 107.794 -1.188 . . . . 4.88 107.794 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.688 ' HB3' ' HG3' ' A' ' 21' ' ' GLU . 10.9 m120 -90.79 57.66 3.62 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 108.623 -0.88 . . . . 2.71 108.623 -176.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.7 p -64.03 -5.83 5.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.929 -1.032 . . . . 5.09 111.63 -175.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -90.82 -28.64 18.06 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 109.048 -0.723 . . . . 5.65 109.048 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.688 ' HG3' ' HB3' ' A' ' 18' ' ' ASN . 30.3 mt-10 -71.02 -56.4 6.23 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.597 -1.183 . . . . 4.31 109.133 171.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.845 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 1.4 mmt180 -46.6 -69.63 0.12 Allowed 'General case' 0 CA--C 1.508 -0.671 0 CA-C-N 112.786 -2.006 . . . . 4.62 113.165 -170.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.729 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 19.7 m -55.97 -15.19 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 124.091 0.869 . . . . 4.83 112.221 -168.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 11.5 mt-10 -89.74 -45.55 9.22 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.072 0.463 . . . . 5.18 110.123 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.845 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 35.2 p-90 -74.6 -17.11 60.76 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 118.612 -1.235 . . . . 3.67 112.391 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.729 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.7 mt -47.68 -30.74 4.01 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.233 0.539 . . . . 4.28 111.244 175.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -99.37 -33.21 10.8 Favored 'General case' 0 N--CA 1.438 -1.049 0 CA-C-N 115.534 -0.757 . . . . 5.96 111.469 -171.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.808 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 58.9 pttt -88.08 -0.8 57.49 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.942 0.401 . . . . 4.78 110.762 178.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.491 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 31.6 mmmt -116.96 -28.92 6.14 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.165 0.431 . . . . 5.96 112.165 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.909 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -69.27 -35.5 76.14 Favored 'General case' 0 N--CA 1.458 -0.05 0 CA-C-O 121.437 0.637 . . . . 5.5 110.328 -173.779 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.909 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -158.73 16.4 0.19 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.013 -0.994 . . . . 4.67 109.303 175.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.563 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 4.7 p-10 40.03 115.4 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 O-C-N 125.41 1.694 . . . . 4.65 112.626 -167.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 33' ' ' VAL . 6.5 p -73.08 59.41 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-O 123.1 1.429 . . . . 5.0 111.695 -172.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -117.22 -14.89 10.47 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 113.597 -1.638 . . . . 8.09 107.678 169.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -118.0 143.8 46.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.211 -1.359 . . . . 4.29 109.513 175.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.684 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 78.4 m-85 -105.06 -52.04 0.11 Allowed Pre-proline 0 C--N 1.318 -0.791 0 CA-C-N 116.489 -0.323 . . . . 5.98 111.706 -178.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.684 ' HD3' ' HB2' ' A' ' 36' ' ' PHE . 98.6 Cg_endo -97.85 89.01 0.07 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.088 0 C-N-CA 122.643 2.229 . . . . 7.44 112.358 170.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.668 ' HD3' ' O ' ' A' ' 36' ' ' PHE . 2.3 Cg_endo -85.04 52.79 3.47 Favored 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 123.299 2.666 . . . . 7.57 111.478 -178.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.9 t70 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.793 -0.622 . . . . 11.49 110.327 -177.571 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo . . . . . 0 N--CA 1.484 0.952 0 N-CA-C 111.352 -0.288 . . . . 7.01 111.352 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -66.97 -65.74 0.04 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.159 1.906 . . . . 8.04 111.606 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.494 ' HA ' ' OE1' ' A' ' 6' ' ' GLU . 2.9 p -85.93 20.04 2.37 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.975 -0.557 . . . . 8.52 111.368 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 94.4 t -103.42 -55.05 6.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.044 -0.525 . . . . 8.21 109.909 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.491 ' HA ' ' NE2' ' A' ' 8' ' ' GLN . 55.5 p -87.71 -12.41 45.4 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.21 -0.45 . . . . 4.77 112.154 -176.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.494 ' OE1' ' HA ' ' A' ' 3' ' ' SER . 10.4 pt-20 -59.57 -22.36 61.63 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 120.971 0.415 . . . . 6.37 111.557 -177.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 46.4 mm -86.0 -36.59 10.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.086 -0.506 . . . . 6.54 111.957 -176.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.491 ' NE2' ' HA ' ' A' ' 5' ' ' SER . 0.9 OUTLIER -96.03 -41.94 8.5 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.368 -0.533 . . . . 6.54 110.465 -175.484 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.491 ' HG ' ' HB2' ' A' ' 5' ' ' SER . 12.7 mt -85.26 -23.99 27.96 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.104 -0.498 . . . . 5.68 110.117 -177.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.412 ' C ' ' H ' ' A' ' 12' ' ' ASN . 54.9 mtt 48.28 91.39 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.354 0 O-C-N 123.74 0.65 . . . . 5.35 111.746 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -71.54 6.6 1.77 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.259 0.552 . . . . 7.56 110.482 -179.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.412 ' H ' ' C ' ' A' ' 10' ' ' MET . 35.3 p30 -87.43 10.5 17.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.507 -0.77 . . . . 5.94 111.147 175.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' A' ' 21' ' ' GLU . 20.5 mmm180 -51.96 133.56 32.43 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.182 -1.044 . . . . 5.45 108.182 174.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.34 -28.42 67.09 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.939 -0.573 . . . . 4.81 113.653 -169.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp 60.91 17.74 8.12 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.432 0.634 . . . . 8.35 110.243 -178.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.9 t60 -82.88 -76.88 0.26 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.111 -0.949 . . . . 4.72 109.76 -176.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 19.8 tp -139.71 59.87 1.58 Allowed 'General case' 0 N--CA 1.436 -1.125 0 CA-C-N 114.901 -1.045 . . . . 4.88 108.193 176.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.64 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 8.1 m120 -79.07 23.6 0.35 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.712 -0.676 . . . . 2.71 110.36 -176.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 17' ' ' LEU . 9.3 t -67.87 -5.5 17.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.403 -0.362 . . . . 5.09 110.31 -178.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 25.3 ptm -99.94 -16.97 17.79 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 122.309 1.052 . . . . 5.65 108.511 178.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 58.9 mt-10 -84.69 -59.51 2.34 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 113.184 -1.825 . . . . 4.31 110.009 175.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.807 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 3.5 mpt_? -48.31 -62.65 1.38 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-N 115.122 -0.945 . . . . 4.62 112.521 -176.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.792 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.6 m -60.67 -6.94 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 O-C-N 123.783 0.677 . . . . 4.83 112.471 -166.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -94.73 -41.87 9.04 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 109.35 -0.611 . . . . 5.18 109.35 175.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.807 ' CE2' ' HA ' ' A' ' 22' ' ' ARG . 40.6 p-90 -80.78 -16.71 53.07 Favored 'General case' 0 CA--C 1.504 -0.819 0 C-N-CA 118.935 -1.106 . . . . 3.67 112.834 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.792 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.8 mt -49.43 -31.12 9.09 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-O 120.87 0.366 . . . . 4.28 111.317 176.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.748 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.85 -37.55 9.39 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.036 0.446 . . . . 5.96 110.952 -170.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.758 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -84.08 1.92 41.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.179 -0.464 . . . . 4.78 111.373 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.55 ' HD2' ' O ' ' A' ' 28' ' ' LYS . 13.9 mmmm -128.28 -24.55 3.09 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 112.964 0.727 . . . . 5.96 112.964 179.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.748 HD23 ' HA ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -59.8 -36.47 76.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.039 0.923 . . . . 5.5 109.471 -175.181 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.575 HE21 ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -159.22 5.73 0.1 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 113.685 -1.598 . . . . 4.67 107.347 169.567 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.551 ' HB2' ' O ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER 51.36 119.36 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 113.32 -1.764 . . . . 4.65 111.814 -166.449 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.419 HG12 ' H ' ' A' ' 33' ' ' VAL . 2.5 p -68.9 -6.23 5.74 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 CA-C-N 113.752 -1.567 . . . . 5.0 112.4 -167.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -61.63 -28.39 69.34 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 122.113 -0.367 . . . . 8.09 111.462 177.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 36' ' ' PHE . 0.4 OUTLIER -99.85 -25.43 14.35 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.491 -0.322 . . . . 4.29 111.446 -179.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' A' ' 35' ' ' ASN . 69.3 m-85 70.31 164.0 0.14 Allowed Pre-proline 0 C--O 1.234 0.281 0 O-C-N 124.166 0.916 . . . . 5.98 110.026 -170.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.586 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 83.4 Cg_exo -44.7 -45.56 13.28 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 122.553 2.169 . . . . 7.44 113.838 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 86.3 Cg_exo -51.92 91.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.361 1.233 0 C-N-CA 122.735 2.29 . . . . 7.57 113.284 171.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.335 -0.841 . . . . 11.49 110.474 179.676 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo . . . . . 0 N--CA 1.482 0.841 0 N-CA-C 110.503 -0.614 . . . . 7.01 110.503 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -72.46 -71.14 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.464 0 C-N-CA 122.926 2.417 . . . . 8.04 113.304 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 p -131.26 -20.92 2.65 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.291 0.478 . . . . 8.52 112.291 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.0 p -62.47 -22.03 28.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.138 0.494 . . . . 8.21 111.169 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.924 ' HB3' HD23 ' A' ' 9' ' ' LEU . 30.4 m -92.52 3.29 55.8 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.214 -0.448 . . . . 4.77 112.16 -178.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.629 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 42.4 mt-10 -71.86 26.4 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.953 -0.299 . . . . 6.37 111.628 174.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.505 HD13 ' O ' ' A' ' 6' ' ' GLU . 29.7 mm -120.46 -59.25 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 121.444 0.64 . . . . 6.54 109.87 173.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.575 ' HG2' HD22 ' A' ' 9' ' ' LEU . 18.3 pm0 -83.86 -26.22 29.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.445 -0.798 . . . . 6.54 110.791 -177.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.924 HD23 ' HB3' ' A' ' 5' ' ' SER . 4.1 mm? -90.12 -49.88 6.32 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.52 -0.472 . . . . 5.68 110.824 175.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.646 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 1.0 OUTLIER -86.19 106.03 17.01 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 120.924 0.393 . . . . 5.35 110.893 -177.303 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -93.43 -2.89 54.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.557 0.694 . . . . 7.56 109.365 176.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.469 ' OD1' ' HB3' ' A' ' 10' ' ' MET . 25.3 p-10 -79.6 8.27 6.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.979 -1.009 . . . . 5.94 110.697 176.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.646 ' HG2' ' O ' ' A' ' 10' ' ' MET . 9.6 mmm180 -84.61 -41.55 16.28 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 120.984 0.421 . . . . 5.45 110.427 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.7 -128.18 1.82 Allowed Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.916 -0.659 . . . . 4.81 111.702 -176.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 15' ' ' LYS . 10.1 mmmm -136.6 126.21 25.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.332 0.11 . . . . 8.35 111.019 -178.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 70.31 -72.41 0.11 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.315 0.579 . . . . 4.72 111.951 174.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 tp -160.71 -47.67 0.05 OUTLIER 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.782 -0.822 . . . . 4.88 108.782 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.807 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 11.8 m120 64.67 -90.02 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.661 -1.154 . . . . 2.71 110.479 -178.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.485 ' H ' ' CD ' ' A' ' 22' ' ' ARG . 22.7 t 62.19 -53.91 0.14 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.007 0.817 . . . . 5.09 111.672 -174.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.435 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.7 ptp -77.75 -27.26 50.38 Favored 'General case' 0 CA--C 1.501 -0.908 0 N-CA-C 108.022 -1.103 . . . . 5.65 108.022 -178.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.807 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 49.0 mt-10 -80.36 -46.03 16.76 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 113.418 -1.719 . . . . 4.31 110.963 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.802 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.7 OUTLIER -48.83 -63.14 1.18 Allowed 'General case' 0 CA--C 1.505 -0.753 0 O-C-N 123.566 0.541 . . . . 4.62 111.147 179.595 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.788 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 30.8 m -64.22 3.62 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 115.554 -0.748 . . . . 4.83 112.376 -169.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 20' ' ' MET . 10.8 mt-10 -100.31 -45.54 5.56 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.104 -0.702 . . . . 5.18 109.104 169.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.887 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 42.7 p-90 -77.79 -18.9 55.9 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 119.494 -0.883 . . . . 3.67 112.726 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.788 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.0 mt -50.35 -28.12 7.42 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 121.126 0.488 . . . . 4.28 111.099 176.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.802 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -103.15 -42.79 5.66 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.592 -0.731 . . . . 5.96 111.0 -172.217 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.887 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.5 pttt -78.32 -5.57 52.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.577 -0.283 . . . . 4.78 111.378 -177.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.437 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 14.1 mmmm -114.87 -34.33 5.15 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.6 -0.44 . . . . 5.96 112.009 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.941 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -57.64 -38.72 75.51 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.948 0.404 . . . . 5.5 110.96 -175.12 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.941 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -159.2 23.17 0.2 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.611 -0.722 . . . . 4.67 109.428 175.678 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 41.04 101.61 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 113.906 -1.497 . . . . 4.65 112.229 -167.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.704 ' HA ' HE22 ' A' ' 31' ' ' GLN . 2.4 p -55.89 138.28 16.51 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.051 0 CA-C-N 113.096 -1.866 . . . . 5.0 112.122 -173.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.424 ' HB3' ' O ' ' A' ' 33' ' ' VAL . 84.7 t60 82.47 -14.04 0.79 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.032 -1.44 . . . . 8.09 110.026 -173.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.5 m120 59.12 97.87 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.952 0.882 . . . . 4.29 111.602 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.86 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 77.7 m-85 -83.17 -57.22 0.44 Allowed Pre-proline 0 C--N 1.315 -0.897 0 CA-C-N 114.752 -1.113 . . . . 5.98 111.367 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.86 ' HD3' ' HB2' ' A' ' 36' ' ' PHE . 34.2 Cg_exo -62.84 -52.67 2.1 Favored 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 122.217 1.945 . . . . 7.44 114.184 174.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.513 ' HD3' ' HD2' ' A' ' 37' ' ' PRO . 12.5 Cg_exo -70.49 92.86 0.58 Allowed 'Trans proline' 0 C--N 1.363 1.29 0 C-N-CA 122.493 2.129 . . . . 7.57 113.405 -174.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.7 t70 . . . . . 0 C--O 1.248 0.988 0 CA-C-N 115.69 -0.686 . . . . 11.49 110.205 173.13 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo . . . . . 0 N--CA 1.482 0.848 0 N-CA-C 110.814 -0.495 . . . . 7.01 110.814 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.63 106.19 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.09 2.527 . . . . 8.04 112.553 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.0 m 60.07 7.7 1.27 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.827 -1.078 . . . . 8.52 111.97 -176.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 80.5 t -80.98 -42.38 20.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.209 0.528 . . . . 8.21 109.79 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.557 ' HA ' HD13 ' A' ' 9' ' ' LEU . 52.8 p -121.84 -26.61 4.8 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.411 -0.516 . . . . 4.77 112.025 174.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -56.64 -20.71 22.72 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.511 0.56 . . . . 6.37 112.511 -172.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 24.9 mm -113.36 -18.68 7.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 111.994 0.368 . . . . 6.54 111.994 -177.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.721 ' HA ' ' HD3' ' A' ' 13' ' ' ARG . 2.2 mp0 -107.12 -26.19 11.22 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.297 -0.561 . . . . 6.54 111.758 -171.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.557 HD13 ' HA ' ' A' ' 5' ' ' SER . 10.4 mp -88.96 -15.73 33.5 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.25 0.548 . . . . 5.68 109.882 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.57 122.74 19.12 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 108.632 -0.877 . . . . 5.35 108.632 165.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -79.69 43.69 0.59 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.413 0.625 . . . . 7.56 110.391 -176.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -113.35 15.56 19.18 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.891 -1.049 . . . . 5.94 108.898 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.721 ' HD3' ' HA ' ' A' ' 8' ' ' GLN . 26.4 mmm180 -60.06 150.72 28.53 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.022 -0.99 . . . . 5.45 110.93 -177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.9 -130.03 2.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.506 -0.854 . . . . 4.81 112.491 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -92.71 -64.62 1.08 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.416 0.627 . . . . 8.35 110.807 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -108.88 -54.52 2.51 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.37 -0.832 . . . . 4.72 109.471 -179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.497 ' HG ' ' H ' ' A' ' 19' ' ' SER . 1.0 OUTLIER 177.55 -46.43 0.01 OUTLIER 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 106.601 -1.629 . . . . 4.88 106.601 -177.529 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.66 ' HB3' ' HB2' ' A' ' 21' ' ' GLU . 21.6 m120 53.81 32.86 15.74 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 113.073 -1.876 . . . . 2.71 111.47 166.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.497 ' H ' ' HG ' ' A' ' 17' ' ' LEU . 33.9 t -61.89 -32.49 72.86 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.5 -0.773 . . . . 5.09 109.066 177.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.783 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 27.9 ptm -76.01 -45.45 34.48 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.863 -0.608 . . . . 5.65 110.085 178.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.66 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 5.9 mp0 -48.71 -57.95 5.51 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.389 0.614 . . . . 4.31 109.736 173.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.704 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -53.19 -64.33 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.33 -1.305 . . . . 4.62 111.945 177.541 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.896 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 10.6 p -55.01 -19.38 4.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 123.587 0.554 . . . . 4.83 111.773 -172.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.783 ' HG2' ' O ' ' A' ' 20' ' ' MET . 8.7 mm-40 -75.04 -58.73 3.1 Favored 'General case' 0 CA--C 1.504 -0.815 0 O-C-N 121.612 -0.68 . . . . 5.18 109.255 169.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.76 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 29.6 p-90 -69.27 -14.09 62.76 Favored 'General case' 0 CA--C 1.495 -1.153 0 N-CA-C 113.784 1.031 . . . . 3.67 113.784 -174.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.896 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.6 mt -49.68 -42.21 44.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.275 1.036 . . . . 4.28 108.253 170.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.612 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.3 mpt_? -99.16 22.39 10.5 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.569 -1.196 . . . . 5.96 111.493 -170.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.76 ' HE2' ' HB3' ' A' ' 25' ' ' TRP . 55.9 pttt -131.81 -21.79 2.42 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.133 -0.485 . . . . 4.78 111.017 162.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.638 ' O ' ' HD3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -160.62 19.32 0.14 Allowed 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 115.063 1.505 . . . . 5.96 115.063 -175.206 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.973 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.0 OUTLIER -62.48 -42.61 99.6 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 119.522 1.056 . . . . 5.5 109.334 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.973 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -163.77 102.36 0.9 Allowed 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 105.125 -2.176 . . . . 4.67 105.125 169.305 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.793 ' HA ' ' ND2' ' A' ' 35' ' ' ASN . 4.2 p-10 -63.6 101.33 0.33 Allowed 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.587 1.184 . . . . 4.65 111.857 -168.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 79.6 t -135.59 -69.14 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 113.196 -1.82 . . . . 5.0 109.646 -176.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -100.72 -13.61 18.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.95 0.881 . . . . 8.09 109.029 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.793 ' ND2' ' HA ' ' A' ' 32' ' ' ASP . 0.6 OUTLIER -97.29 64.18 1.88 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.654 -1.157 . . . . 4.29 109.145 176.635 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.513 ' N ' ' HD2' ' A' ' 37' ' ' PRO . 0.2 OUTLIER -101.8 -25.19 0.21 Allowed Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 114.041 1.126 . . . . 5.98 114.041 -174.383 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 36' ' ' PHE . 37.0 Cg_exo -37.9 -42.53 1.39 Allowed 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.902 2.402 . . . . 7.44 115.637 175.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 33.0 Cg_exo -61.57 84.15 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 122.294 1.996 . . . . 7.57 113.047 173.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.7 t70 . . . . . 0 C--O 1.254 1.309 0 CA-C-O 118.369 -0.824 . . . . 11.49 111.476 176.172 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 0.676 0 N-CA-C 110.661 -0.553 . . . . 7.01 110.661 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.461 ' HB2' ' H ' ' A' ' 3' ' ' SER . 6.2 Cg_exo -71.68 -96.11 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.555 2.17 . . . . 8.04 111.696 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.551 ' HA ' ' HG2' ' A' ' 6' ' ' GLU . 67.5 m -78.29 1.56 21.3 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.242 0.544 . . . . 8.52 110.571 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.36 -53.97 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 115.545 -0.752 . . . . 8.21 109.931 172.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.805 ' HB3' ' HB2' ' A' ' 9' ' ' LEU . 16.0 m -141.17 19.35 2.26 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.945 0.72 . . . . 4.77 112.945 -175.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.695 ' HG3' ' H ' ' A' ' 7' ' ' ILE . 6.3 pt-20 -47.92 -67.47 0.27 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.155 0.428 . . . . 6.37 112.155 -177.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.695 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 27.4 mm -112.61 -1.08 9.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.044 0.449 . . . . 6.54 110.62 -177.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.407 HE21 ' HB2' ' A' ' 8' ' ' GLN . 1.0 OUTLIER -92.22 -55.89 3.26 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.634 -0.426 . . . . 6.54 111.416 -171.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.805 ' HB2' ' HB3' ' A' ' 5' ' ' SER . 3.6 mm? -90.4 19.14 5.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.856 0.36 . . . . 5.68 111.15 -176.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.617 ' HB2' ' HG2' ' A' ' 13' ' ' ARG . 21.0 mtt -63.02 114.24 3.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.006 -0.543 . . . . 5.35 110.885 173.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -68.96 -11.84 61.09 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 122.01 0.91 . . . . 7.56 108.65 170.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -65.91 -29.48 69.91 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.051 -1.431 . . . . 5.94 111.208 172.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.617 ' HG2' ' HB2' ' A' ' 10' ' ' MET . 45.2 mmm-85 -59.97 -43.14 95.27 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.844 0.683 . . . . 5.45 112.844 -171.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -148.06 153.26 25.17 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.149 -1.024 . . . . 4.81 112.495 -175.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -105.95 -59.48 1.77 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.622 0.248 . . . . 8.35 111.21 -178.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -123.85 49.03 1.79 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.205 -0.665 . . . . 4.72 109.205 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 mm? 45.13 78.26 0.06 Allowed 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 122.373 1.082 . . . . 4.88 112.182 -178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.711 ' O ' ' HD2' ' A' ' 22' ' ' ARG . 10.5 m120 -93.09 30.48 1.62 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 113.997 -1.456 . . . . 2.71 109.832 -169.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.3 m -69.16 -3.89 15.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.944 -1.026 . . . . 5.09 110.82 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 22.3 ptt? -95.24 -22.64 17.67 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.176 -1.046 . . . . 5.65 108.176 175.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -85.93 -52.66 5.58 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 113.394 -1.73 . . . . 4.31 109.854 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.887 ' HG3' ' CZ2' ' A' ' 25' ' ' TRP . 0.0 OUTLIER -45.04 -63.45 0.92 Allowed 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.99 -1.004 . . . . 4.62 111.82 -178.544 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.8 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.3 m -62.55 -3.34 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.877 -0.602 . . . . 4.83 112.336 -169.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 27' ' ' ARG . 9.0 mm-40 -96.6 -44.79 6.99 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.586 0.708 . . . . 5.18 109.496 172.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.887 ' CZ2' ' HG3' ' A' ' 22' ' ' ARG . 42.6 p-90 -77.66 -18.11 57.03 Favored 'General case' 0 N--CA 1.44 -0.94 0 C-N-CA 118.853 -1.139 . . . . 3.67 112.95 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.8 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 8.5 mt -48.46 -33.41 9.31 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 121.072 0.463 . . . . 4.28 110.935 175.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.589 ' HA ' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -98.81 -35.82 10.0 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.433 -0.803 . . . . 5.96 111.156 -170.473 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.861 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 61.2 pttt -85.69 -7.01 59.05 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.679 -0.408 . . . . 4.78 111.651 -177.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 30.0 mmmt -118.95 -9.47 10.07 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 119.931 -0.708 . . . . 5.96 112.21 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.711 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.1 OUTLIER -87.45 -36.11 17.88 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 119.94 -0.704 . . . . 5.5 110.082 -178.699 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.711 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -176.98 42.53 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.597 -0.729 . . . . 4.67 109.589 176.165 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.571 ' HB3' ' O ' ' A' ' 28' ' ' LYS . 9.6 p-10 -19.5 108.28 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.603 0 O-C-N 125.083 1.489 . . . . 4.65 114.444 -165.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 11.0 p -127.47 -40.12 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 114.08 -1.418 . . . . 5.0 111.525 -174.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -112.16 41.92 1.88 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.325 0.583 . . . . 8.09 109.728 177.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.497 ' HA ' ' HG2' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -144.01 25.81 1.56 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-N 115.471 -0.786 . . . . 4.29 109.403 -175.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.449 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 30.0 m-85 -73.82 -48.72 6.37 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.338 -0.846 . . . . 5.98 110.769 178.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.619 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 48.3 Cg_exo -56.29 -49.97 13.5 Favored 'Trans proline' 0 C--N 1.357 1.012 0 C-N-CA 121.732 1.621 . . . . 7.44 112.679 170.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.619 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 63.4 Cg_exo -46.44 123.25 6.54 Favored 'Trans proline' 0 C--N 1.366 1.471 0 C-N-CA 122.407 2.072 . . . . 7.57 112.623 169.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.8 t70 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.491 -0.766 . . . . 11.49 111.018 -175.691 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.476 0.456 0 N-CA-C 111.131 -0.373 . . . . 7.01 111.131 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -94.32 -157.79 0.05 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 123.086 2.524 . . . . 8.04 111.839 176.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.542 ' HA ' ' HG3' ' A' ' 6' ' ' GLU . 71.8 m -70.46 -13.34 62.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.824 0.345 . . . . 8.52 111.299 178.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 94.6 t -57.9 -44.65 86.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.028 -0.533 . . . . 8.21 111.203 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.712 ' HA ' ' NE2' ' A' ' 8' ' ' GLN . 5.8 p -90.26 -9.64 47.21 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.618 0.599 . . . . 4.77 112.618 -175.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.542 ' HG3' ' HA ' ' A' ' 3' ' ' SER . 44.0 mt-10 -58.33 -18.5 27.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.031 0.443 . . . . 6.37 110.667 175.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 45.3 mm -73.24 -62.12 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.784 -0.644 . . . . 6.54 111.306 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.712 ' NE2' ' HA ' ' A' ' 5' ' ' SER . 0.9 OUTLIER -102.27 -3.77 26.73 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.407 0.521 . . . . 6.54 112.407 -171.684 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.581 HD23 ' HB2' ' A' ' 5' ' ' SER . 4.2 mm? -102.39 -12.81 17.61 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.449 -0.575 . . . . 5.68 109.449 168.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 64.2 mtt 70.78 133.47 0.03 OUTLIER 'General case' 0 C--N 1.343 0.291 0 CA-C-N 114.778 -1.101 . . . . 5.35 112.816 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -100.9 -7.02 23.87 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.198 -0.667 . . . . 7.56 109.198 167.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -81.84 42.3 0.7 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.383 -0.826 . . . . 5.94 109.99 172.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -58.08 -24.03 56.96 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.662 -0.699 . . . . 5.45 110.802 -177.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -128.23 -90.86 0.68 Allowed Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.758 -0.937 . . . . 4.81 110.758 172.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -145.52 118.65 8.86 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.014 -0.736 . . . . 8.35 109.014 172.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.41 ' HD2' ' HB3' ' A' ' 17' ' ' LEU . 10.9 t60 69.87 -66.22 0.28 Allowed 'General case' 0 N--CA 1.471 0.594 0 O-C-N 123.481 0.488 . . . . 4.72 110.922 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.921 ' HG ' ' H ' ' A' ' 19' ' ' SER . 6.9 tp -165.64 -72.97 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.27 -1.011 . . . . 4.88 108.27 -177.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.564 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 7.1 m120 58.93 15.78 4.15 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.659 -0.701 . . . . 2.71 111.856 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.969 ' HA ' ' HG2' ' A' ' 22' ' ' ARG . 21.3 m -74.71 -6.02 46.47 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.935 -0.478 . . . . 5.09 110.238 178.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.489 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 2.4 ptt? -94.55 -26.17 16.52 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.052 -1.092 . . . . 5.65 108.052 171.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 18' ' ' ASN . 59.1 mm-40 -68.39 -47.45 67.32 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.636 -1.165 . . . . 4.31 109.583 172.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.969 ' HG2' ' HA ' ' A' ' 19' ' ' SER . 22.8 mmt85 -41.5 -69.74 0.13 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-N 114.872 -1.058 . . . . 4.62 110.976 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.676 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 12.2 m -64.2 4.08 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.234 -0.894 . . . . 4.83 112.836 -174.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 20' ' ' MET . 17.6 mt-10 -95.54 -52.22 4.22 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.267 -1.012 . . . . 5.18 108.267 163.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 1.023 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 43.9 p-90 -71.97 -22.81 61.39 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 113.491 0.923 . . . . 3.67 113.491 -175.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.676 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 4.4 mt -55.37 -31.39 61.74 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 119.294 -0.962 . . . . 4.28 108.514 172.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 32' ' ' ASP . 2.5 mpt_? -110.3 -7.07 14.86 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 113.718 1.007 . . . . 5.96 113.718 -171.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 1.023 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 45.6 pttt -113.38 -1.96 14.09 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 119.824 -0.751 . . . . 4.78 110.739 174.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.473 ' CG ' ' HB2' ' A' ' 25' ' ' TRP . 14.7 mmmm -124.06 -26.86 3.96 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.092 0.775 . . . . 5.96 113.092 -173.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.933 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -66.73 -42.23 86.62 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.932 0.872 . . . . 5.5 110.29 -175.093 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.933 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -172.7 21.23 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 105.723 -1.955 . . . . 4.67 105.723 175.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' A' ' 27' ' ' ARG . 9.6 p-10 26.84 101.42 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 111.851 -2.432 . . . . 4.65 113.57 -167.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.658 ' HA ' HE22 ' A' ' 31' ' ' GLN . 8.9 p -65.17 -3.28 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.363 -1.289 . . . . 5.0 110.811 -173.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -54.95 -31.46 60.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.113 -0.949 . . . . 8.09 110.391 167.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.531 ' HB2' ' HD2' ' A' ' 37' ' ' PRO . 0.3 OUTLIER -102.35 138.6 39.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.491 0.663 . . . . 4.29 111.07 175.87 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.676 ' C ' ' HD3' ' A' ' 38' ' ' PRO . 39.6 m-85 -107.02 -6.92 0.11 Allowed Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 114.871 1.434 . . . . 5.98 114.871 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' A' ' 35' ' ' ASN . 45.8 Cg_endo -104.14 69.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.363 1.297 0 CA-C-N 121.908 1.717 . . . . 7.44 114.168 171.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.676 ' HD3' ' C ' ' A' ' 36' ' ' PHE . 6.3 Cg_endo -87.37 74.42 2.58 Favored 'Trans proline' 0 N--CA 1.444 -1.383 0 C-N-CA 122.65 2.233 . . . . 7.57 109.89 173.013 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.2 t70 . . . . . 0 C--O 1.246 0.907 0 O-C-N 124.617 1.198 . . . . 11.49 112.915 -172.465 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.473 ' CB ' ' HB ' ' A' ' 4' ' ' VAL . 3.0 Cg_exo . . . . . 0 N--CA 1.48 0.69 0 N-CA-C 110.604 -0.575 . . . . 7.01 110.604 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.56 -60.02 0.63 Allowed 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.245 2.63 . . . . 8.04 113.038 -173.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.555 ' HA ' ' OE1' ' A' ' 6' ' ' GLU . 66.5 m -95.49 11.64 32.26 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.177 0.513 . . . . 8.52 111.638 -177.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.473 ' HB ' ' CB ' ' A' ' 1' ' ' PRO . 72.3 t -102.27 -42.71 9.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.99 -0.55 . . . . 8.21 109.756 175.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.836 ' HB3' HD23 ' A' ' 9' ' ' LEU . 33.3 m -99.41 1.1 43.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.932 -0.576 . . . . 4.77 112.245 -177.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.555 ' OE1' ' HA ' ' A' ' 3' ' ' SER . 10.0 pt-20 -68.76 -6.11 24.61 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.108 0.48 . . . . 6.37 111.033 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 40.6 mm -96.05 -47.86 12.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.092 -0.504 . . . . 6.54 111.37 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.646 ' OE1' ' HA ' ' A' ' 5' ' ' SER . 5.4 mp0 -89.06 -43.4 11.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.863 0.363 . . . . 6.54 110.186 -174.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.836 HD23 ' HB3' ' A' ' 5' ' ' SER . 3.1 mm? -90.29 -20.93 22.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.049 -0.523 . . . . 5.68 111.783 -173.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.469 ' HB2' ' O ' ' A' ' 6' ' ' GLU . 64.6 mtt -106.46 135.33 48.14 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.451 -0.5 . . . . 5.35 111.123 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -96.23 -4.85 41.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.663 -0.699 . . . . 7.56 110.104 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -77.66 41.66 0.34 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.527 -0.76 . . . . 5.94 112.602 -175.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.08 -18.93 52.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.099 0.476 . . . . 5.45 110.599 178.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.547 ' HA3' HH22 ' A' ' 22' ' ' ARG . . . 174.08 170.91 37.95 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.421 -0.672 . . . . 4.81 111.421 -179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' A' ' 15' ' ' LYS . 2.0 mptt -112.95 152.96 28.75 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.712 -0.477 . . . . 8.35 109.712 -177.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 58.0 t60 61.5 -82.8 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 O-C-N 123.58 0.55 . . . . 4.72 111.466 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.3 tp 177.16 81.84 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.442 -1.318 . . . . 4.88 107.442 -178.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.712 ' HB2' HH21 ' A' ' 22' ' ' ARG . 13.2 m120 -81.66 45.63 0.9 Allowed 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 116.116 -0.493 . . . . 2.71 109.976 -175.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.5 p -65.38 -14.75 61.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.763 -0.653 . . . . 5.09 110.943 -177.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 4.9 ptm -91.34 -24.38 19.81 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 115.797 -0.638 . . . . 5.65 109.602 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.657 ' CG ' ' HB3' ' A' ' 18' ' ' ASN . 22.3 mm-40 -73.2 -52.89 12.43 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.101 -0.954 . . . . 4.31 109.642 173.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.719 ' HD3' ' CZ2' ' A' ' 25' ' ' TRP . 6.7 mmt180 -42.87 -68.7 0.17 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 113.699 -1.591 . . . . 4.62 111.8 -174.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.689 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 13.0 m -56.55 -13.13 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 113.037 0.755 . . . . 4.83 113.037 -171.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.99 -35.78 16.2 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-O 121.425 0.631 . . . . 5.18 109.816 175.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 0.719 ' CZ2' ' HD3' ' A' ' 22' ' ' ARG . 50.7 p-90 -90.32 -8.88 49.72 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 118.927 -1.109 . . . . 3.67 113.041 176.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.689 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 5.5 mt -67.77 11.9 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.771 0.656 . . . . 4.28 112.771 178.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.575 ' HA ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -126.49 -62.52 1.14 Allowed 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.164 -1.05 . . . . 5.96 108.164 173.187 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.661 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 52.7 pttt -61.13 -25.45 67.0 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.412 -0.813 . . . . 4.78 113.19 -176.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.616 ' HG2' ' HG3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -129.37 -17.11 3.81 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.252 0.834 . . . . 5.96 113.252 -176.961 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.06 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.3 OUTLIER -49.21 -39.9 31.59 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.12 0.486 . . . . 5.5 111.34 -172.138 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 1.06 ' HG3' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -167.66 -1.44 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.287 -0.869 . . . . 4.67 110.309 173.13 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.706 ' HA ' ' ND2' ' A' ' 35' ' ' ASN . 31.8 t0 60.23 138.2 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 114.389 -1.278 . . . . 4.65 111.566 -176.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.734 ' HB ' HE22 ' A' ' 31' ' ' GLN . 9.1 p -168.92 -45.72 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 CA-C-N 115.283 -0.871 . . . . 5.0 110.67 -171.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -132.63 29.2 4.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.81 0.814 . . . . 8.09 109.493 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.706 ' ND2' ' HA ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -133.82 24.58 3.98 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.995 -1.002 . . . . 4.29 110.078 -174.337 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.442 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 31.6 m-85 -67.01 -47.44 52.65 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 115.323 -0.853 . . . . 5.98 111.856 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.478 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 50.8 Cg_exo -54.87 -49.8 15.46 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 122.336 2.024 . . . . 7.44 113.782 174.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 11.5 Cg_exo -36.79 111.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.365 1.397 0 C-N-CA 123.248 2.632 . . . . 7.57 113.791 172.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.461 -0.781 . . . . 11.49 111.134 -176.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo . . . . . 0 N--CA 1.48 0.695 0 N-CA-C 110.668 -0.551 . . . . 7.01 110.668 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -66.82 -72.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.985 2.456 . . . . 8.04 112.641 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.5 m -139.93 -35.2 0.53 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 111.891 0.33 . . . . 8.52 111.891 -177.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 76.3 t -49.98 -40.13 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.825 0.345 . . . . 8.21 111.51 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.3 m -136.13 62.54 1.61 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.746 0.308 . . . . 4.77 111.11 174.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.808 ' HG3' ' H ' ' A' ' 7' ' ' ILE . 8.6 pt-20 -81.01 -74.65 0.31 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 120.734 -0.387 . . . . 6.37 110.801 172.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.808 ' H ' ' HG3' ' A' ' 6' ' ' GLU . 29.5 mm -113.54 63.26 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.267 0.556 . . . . 6.54 110.269 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -139.99 -63.02 0.5 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.875 -0.602 . . . . 6.54 110.277 -178.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 9' ' ' LEU . 1.7 pt? -50.21 -30.79 12.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.342 -0.844 . . . . 5.68 112.37 175.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.401 ' H ' HD23 ' A' ' 9' ' ' LEU . 65.8 mtt -75.99 75.72 2.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.981 0.42 . . . . 5.35 110.862 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -77.16 -13.86 59.88 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.666 -0.494 . . . . 7.56 109.666 175.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -65.2 -22.63 66.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.482 -0.781 . . . . 5.94 110.214 173.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 42.06 55.34 3.87 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 124.319 1.012 . . . . 5.45 113.112 172.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.59 -108.21 0.24 Allowed Glycine 0 N--CA 1.444 -0.83 0 C-N-CA 120.644 -0.789 . . . . 4.81 112.29 178.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -132.05 101.24 5.33 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.719 0.295 . . . . 8.35 110.411 -175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 49.98 -118.89 1.22 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.681 -0.691 . . . . 4.72 111.121 176.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 17' ' ' LEU . 23.0 tp -135.17 68.18 1.47 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.55 -0.907 . . . . 4.88 108.55 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.758 ' O ' ' HD3' ' A' ' 22' ' ' ARG . 10.6 m120 -84.49 40.35 0.78 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.479 -0.782 . . . . 2.71 110.687 -178.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.8 m -75.69 3.88 8.86 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.545 0.212 . . . . 5.09 111.523 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.683 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 18.9 ptm -99.49 -36.58 9.5 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 107.912 -1.144 . . . . 5.65 107.912 168.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 18' ' ' ASN . 22.5 mm-40 -65.42 -56.48 12.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.787 -1.097 . . . . 4.31 110.23 176.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.764 ' HA ' ' CE2' ' A' ' 25' ' ' TRP . 1.0 OUTLIER -43.0 -66.39 0.38 Allowed 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.484 -1.235 . . . . 4.62 111.874 -177.138 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.761 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 27.1 m -61.24 -9.48 2.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 112.469 0.544 . . . . 4.83 112.469 -173.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' A' ' 20' ' ' MET . 25.9 mt-10 -83.63 -55.71 4.13 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.477 -0.934 . . . . 5.18 108.477 168.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . 1.048 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 p-90 -70.09 -19.67 63.25 Favored 'General case' 0 N--CA 1.436 -1.174 0 N-CA-C 113.609 0.966 . . . . 3.67 113.609 -173.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.761 ' HG ' ' HA ' ' A' ' 23' ' ' VAL . 9.2 mt -48.81 -34.21 11.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 120.119 -0.632 . . . . 4.28 109.785 173.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 26' ' ' LEU . 3.5 mpt_? -101.59 -25.13 13.99 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.19 -0.913 . . . . 5.96 112.285 -171.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 1.048 ' HG2' ' HA ' ' A' ' 25' ' ' TRP . 60.1 pttt -98.48 3.33 48.23 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.814 -0.354 . . . . 4.78 111.325 178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.628 ' HG2' ' HB2' ' A' ' 25' ' ' TRP . 75.0 mmtt -122.39 -31.96 3.71 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.241 0.46 . . . . 5.96 112.241 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.74 ' HG ' ' HG3' ' A' ' 31' ' ' GLN . 0.2 OUTLIER -63.87 -36.67 84.7 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 121.254 0.549 . . . . 5.5 110.531 -175.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.768 ' NE2' HD22 ' A' ' 35' ' ' ASN . 0.7 OUTLIER -161.69 32.03 0.13 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.127 -0.942 . . . . 4.67 108.877 170.297 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.441 ' O ' ' HB ' ' A' ' 33' ' ' VAL . 6.0 p-10 38.08 -149.37 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 113.751 -1.568 . . . . 4.65 111.974 -175.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.464 ' O ' ' HB2' ' A' ' 34' ' ' HIS . 54.1 t 71.84 -14.8 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 N-CA-C 112.382 0.512 . . . . 5.0 112.382 172.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.464 ' HB2' ' O ' ' A' ' 33' ' ' VAL . 50.2 m80 72.82 18.41 4.13 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.163 0.585 . . . . 8.09 109.778 -174.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.768 HD22 ' NE2' ' A' ' 31' ' ' GLN . 12.1 m120 67.56 96.28 0.06 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 114.714 -1.13 . . . . 4.29 112.073 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.474 ' HB2' ' HD3' ' A' ' 37' ' ' PRO . 2.8 m-85 -114.17 -50.93 0.05 OUTLIER Pre-proline 0 C--N 1.319 -0.733 0 CA-C-N 114.824 -1.08 . . . . 5.98 110.698 176.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.568 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 51.2 Cg_exo -56.27 -48.08 21.12 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 121.868 1.712 . . . . 7.44 112.713 170.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 37' ' ' PRO . 2.7 Cg_exo -77.68 141.79 19.87 Favored 'Trans proline' 0 C--N 1.356 0.965 0 C-N-CA 122.025 1.816 . . . . 7.57 111.18 171.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.367 -0.825 . . . . 11.49 111.31 -176.932 . . . . . . . . 1 1 . 1 stop_ save_