data_1qg1_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 1qg1 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' E' E ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 1 N-CA-C 137.377 9.711 . . . . 0.0 137.377 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.15 -147.83 0.13 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.249 -1.147 . . . . 0.0 109.452 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 3' ' ' HIS . . . . . 0.531 ' CD2' ' HB3' ' E' ' 6' ' ' PHE . 69.2 m80 -148.86 93.48 4.21 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.256 -0.902 . . . . 0.0 109.445 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 4' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -77.37 4.18 6.13 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.854 2.369 . . . . 0.0 110.659 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 5' ' ' TRP . . . . . 0.698 ' CG ' ' CZ ' ' E' ' 28' ' ' PHE . 29.0 p-90 -149.88 -37.8 0.15 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.309 -0.869 . . . . 0.0 109.377 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 6' ' ' PHE . . . . . 0.603 ' CD1' HG23 ' E' ' 30' ' ' ILE . 11.6 t80 -65.49 153.2 42.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.112 -0.993 . . . . 0.0 109.449 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 7' ' ' PHE . . . . . 0.53 ' HB3' ' CG2' ' E' ' 10' ' ' ILE . 1.1 m-85 -117.03 -68.74 0.9 Allowed 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.556 -0.715 . . . . 0.0 109.155 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 8' ' ' GLY . . . . . 0.487 ' O ' ' HB3' ' E' ' 32' ' ' GLU . . . 140.26 -97.05 0.22 Allowed Glycine 0 N--CA 1.487 2.059 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 9' ' ' LYS . . . . . 0.486 ' C ' ' HG2' ' E' ' 34' ' ' GLU . 0.1 OUTLIER -118.72 68.77 0.79 Allowed 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.154 -1.204 . . . . 0.0 110.447 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 10' ' ' ILE . . . . . 0.531 ' C ' ' CG ' ' E' ' 34' ' ' GLU . 0.1 OUTLIER -119.88 168.03 11.14 Favored Pre-proline 0 C--N 1.303 -1.427 0 O-C-N 120.934 -1.103 . . . . 0.0 110.151 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 11' ' ' PRO . . . . . 0.526 ' CD ' ' CB ' ' E' ' 10' ' ' ILE . 32.4 Cg_endo -80.64 136.69 11.01 Favored 'Trans proline' 0 C--N 1.288 -2.628 0 C-N-CA 124.151 3.234 . . . . 0.0 111.121 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 12' ' ' ARG . . . . . 0.561 ' HA ' ' NE ' ' E' ' 31' ' ' ARG . 0.0 OUTLIER -49.62 -38.43 31.98 Favored 'General case' 0 C--N 1.302 -1.491 0 C-N-CA 119.035 -1.066 . . . . 0.0 108.137 178.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.84 -43.17 90.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.732 -0.605 . . . . 0.0 109.592 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 14' ' ' LYS . . . . . 0.514 ' HB2' ' HG2' ' E' ' 11' ' ' PRO . 10.4 tppt? -57.48 -41.47 80.75 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 15' ' ' ALA . . . . . 0.533 ' CB ' ' OG ' ' E' ' 43' ' ' SER . . . -71.68 -22.92 61.59 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 16' ' ' GLU . . . . . 0.536 ' HA ' ' CG1' ' E' ' 50' ' ' VAL . 3.2 mt-10 -82.12 -11.6 58.66 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 17' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -93.81 -50.84 5.17 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 18' ' ' MET . . . . . 0.59 ' HA ' ' HD2' ' E' ' 21' ' ' LYS . 26.9 mmt -65.37 -20.04 66.21 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 19' ' ' LEU . . . . . 0.64 ' CD2' ' CD1' ' E' ' 96' ' ' ILE . 11.3 mt -86.2 -23.39 26.5 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 119.647 -0.821 . . . . 0.0 109.061 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 20' ' ' SER . . . . . . . . . . . . . 23.3 t -73.38 -28.33 61.97 Favored 'General case' 0 C--N 1.297 -1.682 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.497 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 21' ' ' LYS . . . . . 0.59 ' HD2' ' HA ' ' E' ' 18' ' ' MET . 0.0 OUTLIER -91.12 -8.7 48.04 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 117.65 -1.62 . . . . 0.0 108.4 179.001 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 22' ' ' GLN . . . . . 0.626 ' CG ' ' CB ' ' E' ' 27' ' ' ALA . 0.8 OUTLIER -51.53 177.35 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.224 0 O-C-N 121.371 -0.83 . . . . 0.0 109.326 179.399 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 23' ' ' ARG . . . . . 0.646 ' CG ' ' CE1' ' E' ' 24' ' ' HIS . 1.3 ptm180 -130.51 -29.96 1.93 Allowed 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.257 -179.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 24' ' ' HIS . . . . . 0.646 ' CE1' ' CG ' ' E' ' 23' ' ' ARG . 6.6 m-70 -96.88 124.98 41.01 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 120.795 -1.191 . . . . 0.0 108.204 179.212 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 25' ' ' ASP . . . . . 0.499 ' O ' HG21 ' E' ' 91' ' ' ILE . 0.4 OUTLIER -70.05 99.37 1.44 Allowed 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.724 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 26' ' ' GLY . . . . . 0.491 ' O ' ' C ' ' E' ' 27' ' ' ALA . . . 160.54 -26.6 0.3 Allowed Glycine 0 C--N 1.291 -1.96 0 N-CA-C 106.578 -2.609 . . . . 0.0 106.578 -177.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 27' ' ' ALA . . . . . 0.626 ' CB ' ' CG ' ' E' ' 22' ' ' GLN . . . -36.48 137.34 0.29 Allowed 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 178.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 28' ' ' PHE . . . . . 0.698 ' CZ ' ' CG ' ' E' ' 5' ' ' TRP . 1.0 OUTLIER -148.32 162.16 40.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.668 -1.27 . . . . 0.0 111.76 -178.038 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 29' ' ' LEU . . . . . 0.533 ' HB3' HD13 ' E' ' 96' ' ' ILE . 4.5 pp -152.2 155.97 38.82 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 30' ' ' ILE . . . . . 0.603 HG23 ' CD1' ' E' ' 6' ' ' PHE . 3.9 mt -115.04 133.5 61.06 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 C-N-CA 117.53 -1.668 . . . . 0.0 109.713 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 31' ' ' ARG . . . . . 0.561 ' NE ' ' HA ' ' E' ' 12' ' ' ARG . 0.0 OUTLIER -116.09 145.43 43.04 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.829 -177.655 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 32' ' ' GLU . . . . . 0.487 ' HB3' ' O ' ' E' ' 8' ' ' GLY . 32.9 tt0 -96.62 57.66 1.62 Allowed 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.767 -0.583 . . . . 0.0 109.653 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 33' ' ' SER . . . . . 0.54 ' HB2' ' CB ' ' E' ' 39' ' ' ASP . 0.4 OUTLIER 34.53 94.84 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.913 -0.492 . . . . 0.0 110.48 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 34' ' ' GLU . . . . . 0.531 ' CG ' ' C ' ' E' ' 10' ' ' ILE . 1.2 mm-40 -68.53 -18.32 64.34 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.056 -1.028 . . . . 0.0 109.724 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 35' ' ' SER . . . . . . . . . . . . . 18.6 p -88.76 -27.68 20.99 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.209 -0.932 . . . . 0.0 109.164 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 36' ' ' ALA . . . . . 0.491 ' HB1' ' HB3' ' E' ' 33' ' ' SER . . . -88.41 172.29 7.92 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.391 -0.818 . . . . 0.0 109.335 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 37' ' ' PRO . . . . . 0.489 ' HD2' ' HB3' ' E' ' 36' ' ' ALA . 33.8 Cg_endo -77.13 -3.99 14.33 Favored 'Trans proline' 0 C--N 1.304 -1.806 0 C-N-CA 122.381 2.054 . . . . 0.0 108.719 178.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 38' ' ' GLY . . . . . 0.461 ' HA2' ' HG2' ' E' ' 32' ' ' GLU . . . 152.85 69.63 0.01 OUTLIER Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 39' ' ' ASP . . . . . 0.54 ' CB ' ' HB2' ' E' ' 33' ' ' SER . 0.3 OUTLIER -113.0 110.96 21.35 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.41 -1.053 . . . . 0.0 108.892 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 40' ' ' PHE . . . . . 0.549 ' CB ' ' HB ' ' E' ' 55' ' ' VAL . 10.1 m-85 -58.2 157.6 8.11 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.11 -0.994 . . . . 0.0 110.544 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 41' ' ' SER . . . . . 0.516 ' HB2' ' NH1' ' E' ' 31' ' ' ARG . 3.8 m -170.71 -177.85 2.43 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 107.543 -1.281 . . . . 0.0 107.543 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 42' ' ' LEU . . . . . 0.599 ' HB2' ' CG1' ' E' ' 30' ' ' ILE . 0.1 OUTLIER -161.64 132.76 5.27 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.492 -1.38 . . . . 0.0 111.408 179.283 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 43' ' ' SER . . . . . 0.533 ' OG ' ' CB ' ' E' ' 15' ' ' ALA . 1.5 m -102.39 149.45 24.35 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 44' ' ' VAL . . . . . 0.623 ' CG2' ' CE1' ' E' ' 46' ' ' PHE . 5.3 p -154.58 144.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.586 0 O-C-N 121.083 -1.011 . . . . 0.0 109.127 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 45' ' ' LYS . . . . . 0.495 ' HD2' ' HA ' ' E' ' 25' ' ' ASP . 1.6 ttmt -88.85 111.52 22.15 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-O 121.169 0.509 . . . . 0.0 111.006 -178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 46' ' ' PHE . . . . . 0.662 ' CZ ' ' CG2' ' E' ' 85' ' ' VAL . 13.5 m-30 -112.51 95.03 5.21 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.313 -0.867 . . . . 0.0 109.57 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 47' ' ' GLY . . . . . 0.547 ' O ' ' CB ' ' E' ' 48' ' ' ASN . . . 94.56 -35.97 3.98 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.007 -1.637 . . . . 0.0 109.007 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 48' ' ' ASN . . . . . 0.547 ' CB ' ' O ' ' E' ' 47' ' ' GLY . 6.3 t30 158.47 -23.33 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 49' ' ' ASP . . . . . 0.462 ' O ' ' HA ' ' E' ' 45' ' ' LYS . 3.1 m-20 -85.35 171.98 11.44 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 50' ' ' VAL . . . . . 0.541 HG12 ' CD1' ' E' ' 19' ' ' LEU . 34.9 t -120.29 96.96 4.63 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 C-N-CA 118.433 -1.307 . . . . 0.0 111.049 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 51' ' ' GLN . . . . . 0.66 ' HG2' HG11 ' I' ' 6' ' ' VAL . 0.0 OUTLIER -96.02 144.05 26.65 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 178.187 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 52' ' ' HIS . . . . . 0.549 ' O ' ' CA ' ' I' ' 5' ' ' PTR . 0.0 OUTLIER -122.45 153.97 38.4 Favored 'General case' 0 C--N 1.295 -1.777 0 O-C-N 120.996 -1.065 . . . . 0.0 110.59 -179.053 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 53' ' ' PHE . . . . . 0.653 ' CE1' ' CD1' ' E' ' 66' ' ' TRP . 45.3 m-85 -104.43 139.79 38.86 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 54' ' ' LYS . . . . . 0.548 ' HD3' ' CE2' ' I' ' 5' ' ' PTR . 8.9 tptm -79.56 133.19 36.45 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 118.56 -1.256 . . . . 0.0 107.874 177.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 55' ' ' VAL . . . . . 0.549 ' HB ' ' CB ' ' E' ' 40' ' ' PHE . 57.0 t -97.26 133.4 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 56' ' ' LEU . . . . . 0.599 ' HB2' ' CE2' ' E' ' 64' ' ' PHE . 0.1 OUTLIER -124.7 174.06 8.13 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.284 -0.885 . . . . 0.0 109.624 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 57' ' ' ARG . . . . . 0.65 ' CD ' ' CE1' ' E' ' 63' ' ' TYR . 2.2 tpp85 -125.1 138.65 54.17 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.439 -0.788 . . . . 0.0 109.213 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 58' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -73.54 -0.32 14.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.228 -0.92 . . . . 0.0 109.739 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.77 -5.91 83.24 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 60' ' ' ALA . . . . . . . . . . . . . . . -114.94 -18.56 11.24 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.288 -1.125 . . . . 0.0 109.143 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 61' ' ' GLY . . . . . . . . . . . . . . . 132.05 -0.09 4.79 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 62' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -77.97 161.18 27.71 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.125 -1.221 . . . . 0.0 109.539 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 63' ' ' TYR . . . . . 0.65 ' CE1' ' CD ' ' E' ' 57' ' ' ARG . 83.7 m-85 -133.74 131.27 39.2 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.237 -0.914 . . . . 0.0 109.723 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 64' ' ' PHE . . . . . 0.639 ' N ' ' CD1' ' E' ' 64' ' ' PHE . 0.1 OUTLIER -137.59 172.5 12.87 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.114 -0.991 . . . . 0.0 109.221 178.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 65' ' ' LEU . . . . . 0.711 ' O ' ' HB2' ' E' ' 66' ' ' TRP . 0.5 OUTLIER -176.41 57.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.858 -1.151 . . . . 0.0 110.044 179.185 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 66' ' ' TRP . . . . . 0.711 ' HB2' ' O ' ' E' ' 65' ' ' LEU . 0.0 OUTLIER 159.18 -78.01 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 177.643 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 67' ' ' VAL . . . . . . . . . . . . . 3.0 t -133.58 -74.02 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 120.896 -1.128 . . . . 0.0 110.365 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 68' ' ' VAL . . . . . 0.432 HG11 ' N ' ' E' ' 69' ' ' LYS . 20.9 t -80.99 153.9 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.016 -1.052 . . . . 0.0 109.904 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 69' ' ' LYS . . . . . 0.577 ' O ' ' CD1' ' E' ' 70' ' ' PHE . 1.3 pttt -110.47 -177.22 3.18 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.347 -0.846 . . . . 0.0 109.375 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 70' ' ' PHE . . . . . 0.577 ' CD1' ' O ' ' E' ' 69' ' ' LYS . 67.0 m-85 -153.55 -167.52 2.71 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.218 -0.926 . . . . 0.0 109.954 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 71' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.53 10.39 12.58 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.449 -0.782 . . . . 0.0 109.129 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 72' ' ' SER . . . . . 0.531 ' CB ' ' HG3' ' E' ' 75' ' ' GLU . 0.3 OUTLIER -156.01 151.55 27.02 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 121.199 -0.938 . . . . 0.0 109.896 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 73' ' ' LEU . . . . . 0.533 HD22 ' N ' ' E' ' 73' ' ' LEU . 1.3 mt -66.67 -64.24 0.9 Allowed 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 74' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -21.92 5.8 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 75' ' ' GLU . . . . . 0.531 ' HG3' ' CB ' ' E' ' 72' ' ' SER . 4.0 mm-40 -67.02 -46.56 74.1 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 178.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 76' ' ' LEU . . . . . 0.537 ' CD2' ' HA ' ' E' ' 64' ' ' PHE . 0.5 OUTLIER -63.17 -27.88 69.67 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 77' ' ' VAL . . . . . 0.65 ' CG1' ' CE2' ' E' ' 28' ' ' PHE . 62.2 t -66.95 -66.96 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 78' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' E' ' 81' ' ' ARG . 3.7 m-20 -46.36 -43.8 16.4 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.764 -0.585 . . . . 0.0 109.719 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 79' ' ' TYR . . . . . 0.548 ' CG ' ' CZ ' ' E' ' 70' ' ' PHE . 2.9 t80 -57.23 -58.23 9.11 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.001 -1.062 . . . . 0.0 109.195 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 80' ' ' HIS . . . . . 0.485 ' O ' ' HB3' ' E' ' 92' ' ' PHE . 1.5 m170 -71.03 -4.37 24.6 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.486 -0.759 . . . . 0.0 109.454 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 81' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' E' ' 78' ' ' ASP . 5.1 mtm180 -80.4 -24.52 39.63 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.85 -16.79 13.48 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 83' ' ' THR . . . . . 0.554 ' C ' ' CE2' ' E' ' 92' ' ' PHE . 10.2 m -110.09 137.03 48.4 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 84' ' ' SER . . . . . 0.523 ' N ' ' CE2' ' E' ' 92' ' ' PHE . 0.2 OUTLIER -52.55 -170.55 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.259 -0.901 . . . . 0.0 110.185 -179.345 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 85' ' ' VAL . . . . . 0.662 ' CG2' ' CZ ' ' E' ' 46' ' ' PHE . 0.4 OUTLIER -138.93 -36.62 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 O-C-N 121.564 -0.71 . . . . 0.0 109.506 -179.339 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 86' ' ' SER . . . . . . . . . . . . . 3.7 t -114.5 150.65 34.53 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.407 -0.808 . . . . 0.0 109.551 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.9 12.19 6.53 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.262 -0.898 . . . . 0.0 109.668 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 88' ' ' ASN . . . . . 0.459 ' O ' ' HG3' ' E' ' 89' ' ' GLN . 5.2 t30 -103.41 -26.92 12.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -0.938 . . . . 0.0 109.423 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 89' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' E' ' 88' ' ' ASN . 25.8 mt-30 -153.79 -172.92 4.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 109.329 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.69 80.85 1.36 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.187 -0.946 . . . . 0.0 109.631 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 91' ' ' ILE . . . . . 0.66 HG23 ' CE1' ' E' ' 46' ' ' PHE . 1.3 mt -105.12 153.9 6.67 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.093 -1.004 . . . . 0.0 108.869 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 92' ' ' PHE . . . . . 0.554 ' CE2' ' C ' ' E' ' 83' ' ' THR . 7.3 m-85 -142.78 157.66 44.41 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.105 -0.997 . . . . 0.0 109.587 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 93' ' ' LEU . . . . . 0.657 ' CD1' ' CG ' ' E' ' 28' ' ' PHE . 0.2 OUTLIER -61.59 139.0 58.33 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.105 -0.997 . . . . 0.0 108.95 179.307 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 94' ' ' ARG . . . . . 0.549 ' HB2' ' HA ' ' E' ' 27' ' ' ALA . 0.2 OUTLIER -137.97 -173.91 3.64 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.186 -0.946 . . . . 0.0 109.554 179.725 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 95' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -89.2 134.54 33.99 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.866 -1.146 . . . . 0.0 110.24 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' E' E ' 96' ' ' ILE . . . . . 0.64 ' CD1' ' CD2' ' E' ' 19' ' ' LEU . 20.4 mt -113.02 157.11 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.192 -0.943 . . . . 0.0 110.7 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 97' ' ' GLU . . . . . 0.537 ' O ' ' O ' ' E' ' 96' ' ' ILE . 0.0 OUTLIER 41.34 -175.93 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.743 0.782 . . . . 0.0 111.066 177.625 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 98' ' ' GLN . . . . . 0.604 ' O ' ' O ' ' E' ' 99' ' ' VAL . 3.4 mt-30 73.99 -14.05 0.71 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.469 -0.769 . . . . 0.0 111.659 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 99' ' ' VAL . . . . . 0.631 ' HB ' ' HD2' ' E' ' 100' ' ' PRO . 14.2 m 48.12 169.47 0.02 OUTLIER Pre-proline 0 N--CA 1.502 2.131 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -178.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 100' ' ' PRO . . . . . 0.631 ' HD2' ' HB ' ' E' ' 99' ' ' VAL . 30.2 Cg_endo -74.47 78.46 2.7 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 121.156 1.237 . . . . 0.0 111.945 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 101' ' ' GLN . . . . . 0.577 ' O ' ' CB ' ' E' ' 102' ' ' GLN . 0.8 OUTLIER 1.1 112.33 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.481 0 C-N-CA 123.252 0.621 . . . . 0.0 111.42 179.809 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 102' ' ' GLN . . . . . 0.763 ' N ' ' CD ' ' E' ' 103' ' ' PRO . 0.7 OUTLIER 98.69 10.73 0.0 OUTLIER Pre-proline 0 N--CA 1.499 2.005 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.49 -178.263 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' E' E ' 103' ' ' PRO . . . . . 0.763 ' CD ' ' N ' ' E' ' 102' ' ' GLN . 41.5 Cg_endo -81.39 73.64 5.8 Favored 'Trans proline' 0 N--CA 1.479 0.657 0 C-N-CA 121.09 1.193 . . . . 0.0 110.295 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' E' E ' 104' ' ' THR . . . . . 0.433 ' C ' ' O ' ' E' ' 103' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 117.866 -1.064 . . . . 0.0 109.876 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 1' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' I' I ' 2' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' I' ' 2' ' ' ASP . 0.5 OUTLIER -107.44 138.3 19.9 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.239 -0.913 . . . . 0.0 109.382 -179.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 3' ' ' PRO . . . . . 0.542 ' CG ' ' HD2' ' E' ' 12' ' ' ARG . 37.1 Cg_endo -80.12 -21.5 7.9 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.595 2.196 . . . . 0.0 110.311 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 4' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' I' ' 3' ' ' PRO . 3.0 m 77.53 -177.27 0.11 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.502 -0.749 . . . . 0.0 109.116 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 5' ' ' PTR . . . . . 0.582 ' O ' ' C ' ' I' ' 6' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' I' I ' 6' ' ' VAL . . . . . 0.66 HG11 ' HG2' ' E' ' 51' ' ' GLN . 0.2 OUTLIER -5.77 -68.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 7' ' ' ASN . . . . . 0.645 ' OD1' ' N ' ' I' ' 8' ' ' VAL . 14.5 p30 -63.4 -46.09 88.04 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.658 -1.276 . . . . 0.0 110.214 -178.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 8' ' ' VAL . . . . . 0.645 ' N ' ' OD1' ' I' ' 7' ' ' ASN . 13.0 p -9.3 123.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 CA-C-O 121.07 0.462 . . . . 0.0 111.375 178.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 9' ' ' GLN . . . . . 0.464 ' O ' ' O ' ' I' ' 10' ' ' ASN . 10.9 pt20 -50.2 149.9 2.7 Favored 'General case' 0 C--N 1.297 -1.676 0 C-N-CA 118.885 -1.126 . . . . 0.0 109.408 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 10' ' ' ASN . . . . . 0.464 ' O ' ' O ' ' I' ' 9' ' ' GLN . 0.5 OUTLIER -43.03 166.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.401 -0.812 . . . . 0.0 109.464 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 11' ' ' LEU . . . . . 0.434 ' O ' ' C ' ' I' ' 12' ' ' ASP . 0.1 OUTLIER -76.8 3.84 11.01 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.189 -0.945 . . . . 0.0 109.844 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' I' I ' 12' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' I' ' 11' ' ' LEU . 2.0 m-20 -43.65 -40.41 4.12 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.156 -0.965 . . . . 0.0 109.289 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' I' I ' 13' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' I' ' 12' ' ' ASP . 5.7 mmtm . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.626 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 1 N-CA-C 137.377 9.711 . . . . 0.0 137.377 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.15 -147.83 0.13 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.249 -1.147 . . . . 0.0 109.452 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 3' ' ' HIS . . . . . 0.551 ' CD2' ' HB3' ' E' ' 6' ' ' PHE . 69.2 m80 -148.86 93.48 4.21 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.256 -0.902 . . . . 0.0 109.445 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 4' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -77.37 4.18 6.13 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.854 2.369 . . . . 0.0 110.659 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 5' ' ' TRP . . . . . 0.958 ' CZ3' HD12 ' E' ' 30' ' ' ILE . 29.0 p-90 -149.88 -37.8 0.15 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.309 -0.869 . . . . 0.0 109.377 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 6' ' ' PHE . . . . . 1.022 ' CE1' HG22 ' E' ' 30' ' ' ILE . 11.6 t80 -65.49 153.2 42.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.112 -0.993 . . . . 0.0 109.449 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 7' ' ' PHE . . . . . 0.84 ' HE2' HD22 ' E' ' 29' ' ' LEU . 1.1 m-85 -117.03 -68.74 0.9 Allowed 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.556 -0.715 . . . . 0.0 109.155 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 8' ' ' GLY . . . . . 0.509 ' O ' ' HB3' ' E' ' 32' ' ' GLU . . . 140.26 -97.05 0.22 Allowed Glycine 0 N--CA 1.487 2.059 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 9' ' ' LYS . . . . . 0.507 ' C ' ' HG2' ' E' ' 34' ' ' GLU . 0.1 OUTLIER -118.72 68.77 0.79 Allowed 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.154 -1.204 . . . . 0.0 110.447 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 10' ' ' ILE . . . . . 0.548 ' CG2' ' HB3' ' E' ' 7' ' ' PHE . 0.1 OUTLIER -119.88 168.03 11.14 Favored Pre-proline 0 C--N 1.303 -1.427 0 O-C-N 120.934 -1.103 . . . . 0.0 110.151 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 11' ' ' PRO . . . . . 0.551 ' HG2' ' HB2' ' E' ' 14' ' ' LYS . 32.4 Cg_endo -80.64 136.69 11.01 Favored 'Trans proline' 0 C--N 1.288 -2.628 0 C-N-CA 124.151 3.234 . . . . 0.0 111.121 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 12' ' ' ARG . . . . . 0.587 ' HA ' ' NE ' ' E' ' 31' ' ' ARG . 0.0 OUTLIER -49.62 -38.43 31.98 Favored 'General case' 0 C--N 1.302 -1.491 0 C-N-CA 119.035 -1.066 . . . . 0.0 108.137 178.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.84 -43.17 90.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.732 -0.605 . . . . 0.0 109.592 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 14' ' ' LYS . . . . . 0.551 ' HB2' ' HG2' ' E' ' 11' ' ' PRO . 10.4 tppt? -57.48 -41.47 80.75 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 15' ' ' ALA . . . . . 0.968 ' HB1' HD21 ' E' ' 29' ' ' LEU . . . -71.68 -22.92 61.59 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 16' ' ' GLU . . . . . 0.882 ' HA ' HG11 ' E' ' 50' ' ' VAL . 3.2 mt-10 -82.12 -11.6 58.66 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 17' ' ' GLU . . . . . 0.414 ' HB3' ' HE3' ' E' ' 18' ' ' MET . 1.7 mt-10 -93.81 -50.84 5.17 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 18' ' ' MET . . . . . 0.607 ' HA ' ' HE2' ' E' ' 18' ' ' MET . 26.9 mmt -65.37 -20.04 66.21 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 19' ' ' LEU . . . . . 0.875 HD21 ' CD1' ' E' ' 96' ' ' ILE . 11.3 mt -86.2 -23.39 26.5 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 119.647 -0.821 . . . . 0.0 109.061 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 20' ' ' SER . . . . . . . . . . . . . 23.3 t -73.38 -28.33 61.97 Favored 'General case' 0 C--N 1.297 -1.682 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.497 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 21' ' ' LYS . . . . . 0.584 ' HD2' ' HA ' ' E' ' 18' ' ' MET . 0.0 OUTLIER -91.12 -8.7 48.04 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 117.65 -1.62 . . . . 0.0 108.4 179.001 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 22' ' ' GLN . . . . . 0.626 ' CG ' ' CB ' ' E' ' 27' ' ' ALA . 0.8 OUTLIER -51.53 177.35 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.224 0 O-C-N 121.371 -0.83 . . . . 0.0 109.326 179.399 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 23' ' ' ARG . . . . . 0.646 ' CG ' ' CE1' ' E' ' 24' ' ' HIS . 1.3 ptm180 -130.51 -29.96 1.93 Allowed 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.257 -179.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 24' ' ' HIS . . . . . 0.646 ' CE1' ' CG ' ' E' ' 23' ' ' ARG . 6.6 m-70 -96.88 124.98 41.01 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 120.795 -1.191 . . . . 0.0 108.204 179.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 25' ' ' ASP . . . . . 0.539 ' HA ' ' HD2' ' E' ' 45' ' ' LYS . 0.4 OUTLIER -70.05 99.37 1.44 Allowed 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.724 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 26' ' ' GLY . . . . . 0.491 ' O ' ' C ' ' E' ' 27' ' ' ALA . . . 160.54 -26.6 0.3 Allowed Glycine 0 C--N 1.291 -1.96 0 N-CA-C 106.578 -2.609 . . . . 0.0 106.578 -177.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 27' ' ' ALA . . . . . 0.864 ' HB1' HG12 ' E' ' 96' ' ' ILE . . . -36.48 137.34 0.29 Allowed 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 178.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 28' ' ' PHE . . . . . 1.203 ' CG ' HD13 ' E' ' 93' ' ' LEU . 1.0 OUTLIER -148.32 162.16 40.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.668 -1.27 . . . . 0.0 111.76 -178.038 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 29' ' ' LEU . . . . . 0.968 HD21 ' HB1' ' E' ' 15' ' ' ALA . 4.5 pp -152.2 155.97 38.82 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 30' ' ' ILE . . . . . 1.022 HG22 ' CE1' ' E' ' 6' ' ' PHE . 3.9 mt -115.04 133.5 61.06 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 C-N-CA 117.53 -1.668 . . . . 0.0 109.713 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 31' ' ' ARG . . . . . 0.587 ' NE ' ' HA ' ' E' ' 12' ' ' ARG . 0.0 OUTLIER -116.09 145.43 43.04 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.829 -177.655 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 32' ' ' GLU . . . . . 0.509 ' HB3' ' O ' ' E' ' 8' ' ' GLY . 32.9 tt0 -96.62 57.66 1.62 Allowed 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.767 -0.583 . . . . 0.0 109.653 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 33' ' ' SER . . . . . 0.604 ' HB3' ' HB3' ' E' ' 36' ' ' ALA . 0.4 OUTLIER 34.53 94.84 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.913 -0.492 . . . . 0.0 110.48 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 34' ' ' GLU . . . . . 0.546 ' HG2' ' N ' ' E' ' 10' ' ' ILE . 1.2 mm-40 -68.53 -18.32 64.34 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.056 -1.028 . . . . 0.0 109.724 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 35' ' ' SER . . . . . . . . . . . . . 18.6 p -88.76 -27.68 20.99 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.209 -0.932 . . . . 0.0 109.164 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 36' ' ' ALA . . . . . 0.873 ' HB1' ' HD2' ' E' ' 37' ' ' PRO . . . -88.41 172.29 7.92 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.391 -0.818 . . . . 0.0 109.335 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 37' ' ' PRO . . . . . 0.873 ' HD2' ' HB1' ' E' ' 36' ' ' ALA . 33.8 Cg_endo -77.13 -3.99 14.33 Favored 'Trans proline' 0 C--N 1.304 -1.806 0 C-N-CA 122.381 2.054 . . . . 0.0 108.719 178.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 38' ' ' GLY . . . . . 0.499 ' HA2' ' HG2' ' E' ' 32' ' ' GLU . . . 152.85 69.63 0.01 OUTLIER Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 39' ' ' ASP . . . . . 0.545 ' CB ' ' HB2' ' E' ' 33' ' ' SER . 0.3 OUTLIER -113.0 110.96 21.35 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.41 -1.053 . . . . 0.0 108.892 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 40' ' ' PHE . . . . . 0.558 ' CB ' ' HB ' ' E' ' 55' ' ' VAL . 10.1 m-85 -58.2 157.6 8.11 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.11 -0.994 . . . . 0.0 110.544 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 41' ' ' SER . . . . . 0.532 ' HB2' ' NH1' ' E' ' 31' ' ' ARG . 3.8 m -170.71 -177.85 2.43 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 107.543 -1.281 . . . . 0.0 107.543 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 42' ' ' LEU . . . . . 0.817 HD12 ' N ' ' E' ' 43' ' ' SER . 0.1 OUTLIER -161.64 132.76 5.27 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.492 -1.38 . . . . 0.0 111.408 179.283 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 43' ' ' SER . . . . . 0.817 ' N ' HD12 ' E' ' 42' ' ' LEU . 1.5 m -102.39 149.45 24.35 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 44' ' ' VAL . . . . . 0.623 ' CG2' ' CE1' ' E' ' 46' ' ' PHE . 5.3 p -154.58 144.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.586 0 O-C-N 121.083 -1.011 . . . . 0.0 109.127 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 45' ' ' LYS . . . . . 0.539 ' HD2' ' HA ' ' E' ' 25' ' ' ASP . 1.6 ttmt -88.85 111.52 22.15 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-O 121.169 0.509 . . . . 0.0 111.006 -178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 46' ' ' PHE . . . . . 1.099 ' CZ ' HG21 ' E' ' 85' ' ' VAL . 13.5 m-30 -112.51 95.03 5.21 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.313 -0.867 . . . . 0.0 109.57 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 47' ' ' GLY . . . . . 0.547 ' O ' ' CB ' ' E' ' 48' ' ' ASN . . . 94.56 -35.97 3.98 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.007 -1.637 . . . . 0.0 109.007 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 48' ' ' ASN . . . . . 0.547 ' CB ' ' O ' ' E' ' 47' ' ' GLY . 6.3 t30 158.47 -23.33 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 49' ' ' ASP . . . . . 0.488 ' O ' ' HA ' ' E' ' 45' ' ' LYS . 3.1 m-20 -85.35 171.98 11.44 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 50' ' ' VAL . . . . . 0.882 HG11 ' HA ' ' E' ' 16' ' ' GLU . 34.9 t -120.29 96.96 4.63 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 C-N-CA 118.433 -1.307 . . . . 0.0 111.049 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 51' ' ' GLN . . . . . 0.719 ' HG2' HG12 ' I' ' 6' ' ' VAL . 0.0 OUTLIER -96.02 144.05 26.65 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 178.187 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 52' ' ' HIS . . . . . 0.556 ' HB3' ' O ' ' E' ' 42' ' ' LEU . 0.0 OUTLIER -122.45 153.97 38.4 Favored 'General case' 0 C--N 1.295 -1.777 0 O-C-N 120.996 -1.065 . . . . 0.0 110.59 -179.053 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 53' ' ' PHE . . . . . 0.754 ' HE1' HG21 ' I' ' 6' ' ' VAL . 45.3 m-85 -104.43 139.79 38.86 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 54' ' ' LYS . . . . . 0.574 ' HD3' ' CE2' ' I' ' 5' ' ' PTR . 8.9 tptm -79.56 133.19 36.45 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 118.56 -1.256 . . . . 0.0 107.874 177.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 55' ' ' VAL . . . . . 0.889 ' C ' HD23 ' E' ' 56' ' ' LEU . 57.0 t -97.26 133.4 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 56' ' ' LEU . . . . . 0.889 HD23 ' C ' ' E' ' 55' ' ' VAL . 0.1 OUTLIER -124.7 174.06 8.13 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.284 -0.885 . . . . 0.0 109.624 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 57' ' ' ARG . . . . . 0.65 ' CD ' ' CE1' ' E' ' 63' ' ' TYR . 2.2 tpp85 -125.1 138.65 54.17 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.439 -0.788 . . . . 0.0 109.213 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 58' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -73.54 -0.32 14.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.228 -0.92 . . . . 0.0 109.739 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.77 -5.91 83.24 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 60' ' ' ALA . . . . . . . . . . . . . . . -114.94 -18.56 11.24 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.288 -1.125 . . . . 0.0 109.143 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 61' ' ' GLY . . . . . . . . . . . . . . . 132.05 -0.09 4.79 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 62' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -77.97 161.18 27.71 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.125 -1.221 . . . . 0.0 109.539 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 63' ' ' TYR . . . . . 0.797 ' O ' HD11 ' E' ' 76' ' ' LEU . 83.7 m-85 -133.74 131.27 39.2 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.237 -0.914 . . . . 0.0 109.723 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 64' ' ' PHE . . . . . 0.772 ' HA ' HD21 ' E' ' 76' ' ' LEU . 0.1 OUTLIER -137.59 172.5 12.87 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.114 -0.991 . . . . 0.0 109.221 178.859 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 65' ' ' LEU . . . . . 0.783 HD22 HG22 ' E' ' 55' ' ' VAL . 0.5 OUTLIER -176.41 57.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.858 -1.151 . . . . 0.0 110.044 179.185 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 66' ' ' TRP . . . . . 0.712 ' HB2' ' O ' ' E' ' 65' ' ' LEU . 0.0 OUTLIER 159.18 -78.01 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 177.643 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 67' ' ' VAL . . . . . . . . . . . . . 3.0 t -133.58 -74.02 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 120.896 -1.128 . . . . 0.0 110.365 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 68' ' ' VAL . . . . . . . . . . . . . 20.9 t -80.99 153.9 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.016 -1.052 . . . . 0.0 109.904 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 69' ' ' LYS . . . . . 0.577 ' O ' ' CD1' ' E' ' 70' ' ' PHE . 1.3 pttt -110.47 -177.22 3.18 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.347 -0.846 . . . . 0.0 109.375 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 70' ' ' PHE . . . . . 0.577 ' CD1' ' O ' ' E' ' 69' ' ' LYS . 67.0 m-85 -153.55 -167.52 2.71 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.218 -0.926 . . . . 0.0 109.954 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 71' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -118.53 10.39 12.58 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.449 -0.782 . . . . 0.0 109.129 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 72' ' ' SER . . . . . 0.635 ' O ' HD12 ' E' ' 76' ' ' LEU . 0.3 OUTLIER -156.01 151.55 27.02 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 121.199 -0.938 . . . . 0.0 109.896 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 73' ' ' LEU . . . . . 0.623 HD23 ' N ' ' E' ' 73' ' ' LEU . 1.3 mt -66.67 -64.24 0.9 Allowed 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -53.18 -21.92 5.8 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 75' ' ' GLU . . . . . 0.547 ' CG ' ' HB3' ' E' ' 72' ' ' SER . 4.0 mm-40 -67.02 -46.56 74.1 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 178.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 76' ' ' LEU . . . . . 0.797 HD11 ' O ' ' E' ' 63' ' ' TYR . 0.5 OUTLIER -63.17 -27.88 69.67 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 77' ' ' VAL . . . . . 0.685 HG13 ' CE2' ' E' ' 28' ' ' PHE . 62.2 t -66.95 -66.96 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 78' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' E' ' 81' ' ' ARG . 3.7 m-20 -46.36 -43.8 16.4 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.764 -0.585 . . . . 0.0 109.719 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 79' ' ' TYR . . . . . 0.548 ' CG ' ' CZ ' ' E' ' 70' ' ' PHE . 2.9 t80 -57.23 -58.23 9.11 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.001 -1.062 . . . . 0.0 109.195 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 80' ' ' HIS . . . . . 0.532 ' CE1' ' HE2' ' E' ' 79' ' ' TYR . 1.6 m-70 -71.03 -4.37 24.6 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.486 -0.759 . . . . 0.0 109.454 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 81' ' ' ARG . . . . . 0.497 ' HG3' HG12 ' E' ' 77' ' ' VAL . 5.1 mtm180 -80.4 -24.52 39.63 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.85 -16.79 13.48 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 83' ' ' THR . . . . . 0.554 ' C ' ' CE2' ' E' ' 92' ' ' PHE . 10.2 m -110.09 137.03 48.4 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 84' ' ' SER . . . . . 0.523 ' N ' ' CE2' ' E' ' 92' ' ' PHE . 0.2 OUTLIER -52.55 -170.55 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.259 -0.901 . . . . 0.0 110.185 -179.345 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 85' ' ' VAL . . . . . 1.099 HG21 ' CZ ' ' E' ' 46' ' ' PHE . 0.4 OUTLIER -138.93 -36.62 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 O-C-N 121.564 -0.71 . . . . 0.0 109.506 -179.339 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 86' ' ' SER . . . . . . . . . . . . . 3.7 t -114.5 150.65 34.53 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.407 -0.808 . . . . 0.0 109.551 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.9 12.19 6.53 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.262 -0.898 . . . . 0.0 109.668 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 88' ' ' ASN . . . . . 0.48 ' O ' ' HG3' ' E' ' 89' ' ' GLN . 5.2 t30 -103.41 -26.92 12.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -0.938 . . . . 0.0 109.423 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 89' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' E' ' 88' ' ' ASN . 25.8 mt-30 -153.79 -172.92 4.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 109.329 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.69 80.85 1.36 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.187 -0.946 . . . . 0.0 109.631 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 91' ' ' ILE . . . . . 1.051 HG21 ' CD1' ' E' ' 46' ' ' PHE . 1.3 mt -105.12 153.9 6.67 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.093 -1.004 . . . . 0.0 108.869 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 92' ' ' PHE . . . . . 0.554 ' CE2' ' C ' ' E' ' 83' ' ' THR . 7.3 m-85 -142.78 157.66 44.41 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.105 -0.997 . . . . 0.0 109.587 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 93' ' ' LEU . . . . . 1.203 HD13 ' CG ' ' E' ' 28' ' ' PHE . 0.2 OUTLIER -61.59 139.0 58.33 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.105 -0.997 . . . . 0.0 108.95 179.307 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 94' ' ' ARG . . . . . 0.55 ' HB2' ' HA ' ' E' ' 27' ' ' ALA . 0.2 OUTLIER -137.97 -173.91 3.64 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.186 -0.946 . . . . 0.0 109.554 179.725 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 95' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -89.2 134.54 33.99 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.866 -1.146 . . . . 0.0 110.24 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' E' E ' 96' ' ' ILE . . . . . 0.875 ' CD1' HD21 ' E' ' 19' ' ' LEU . 20.4 mt -113.02 157.11 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.192 -0.943 . . . . 0.0 110.7 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 97' ' ' GLU . . . . . 0.537 ' O ' ' O ' ' E' ' 96' ' ' ILE . 0.0 OUTLIER 41.34 -175.93 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.743 0.782 . . . . 0.0 111.066 177.625 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 98' ' ' GLN . . . . . 0.604 ' O ' ' O ' ' E' ' 99' ' ' VAL . 3.4 mt-30 73.99 -14.05 0.71 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.469 -0.769 . . . . 0.0 111.659 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 99' ' ' VAL . . . . . 0.697 ' HB ' ' HD2' ' E' ' 100' ' ' PRO . 14.2 m 48.12 169.47 0.02 OUTLIER Pre-proline 0 N--CA 1.502 2.131 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -178.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 100' ' ' PRO . . . . . 0.697 ' HD2' ' HB ' ' E' ' 99' ' ' VAL . 30.2 Cg_endo -74.47 78.46 2.7 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 121.156 1.237 . . . . 0.0 111.945 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 101' ' ' GLN . . . . . 0.577 ' O ' ' CB ' ' E' ' 102' ' ' GLN . 9.5 mm-40 1.1 112.33 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.481 0 C-N-CA 123.252 0.621 . . . . 0.0 111.42 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 102' ' ' GLN . . . . . 0.763 ' N ' ' CD ' ' E' ' 103' ' ' PRO . 0.7 OUTLIER 98.69 10.73 0.0 OUTLIER Pre-proline 0 N--CA 1.499 2.005 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.49 -178.263 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' E' E ' 103' ' ' PRO . . . . . 0.763 ' CD ' ' N ' ' E' ' 102' ' ' GLN . 41.5 Cg_endo -81.39 73.64 5.8 Favored 'Trans proline' 0 N--CA 1.479 0.657 0 C-N-CA 121.09 1.193 . . . . 0.0 110.295 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' E' E ' 104' ' ' THR . . . . . 0.438 HG23 ' C ' ' E' ' 103' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 117.866 -1.064 . . . . 0.0 109.876 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 1' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' I' I ' 2' ' ' ASP . . . . . 0.429 ' N ' ' OD1' ' I' ' 2' ' ' ASP . 0.5 OUTLIER -107.44 138.3 19.9 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.239 -0.913 . . . . 0.0 109.382 -179.932 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 3' ' ' PRO . . . . . 0.567 ' CG ' ' HD2' ' E' ' 12' ' ' ARG . 37.1 Cg_endo -80.12 -21.5 7.9 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.595 2.196 . . . . 0.0 110.311 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 4' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' I' ' 3' ' ' PRO . 3.0 m 77.53 -177.27 0.11 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.502 -0.749 . . . . 0.0 109.116 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 5' ' ' PTR . . . . . 0.814 ' O ' HG12 ' I' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' I' I ' 6' ' ' VAL . . . . . 0.825 HG22 ' N ' ' I' ' 7' ' ' ASN . 0.2 OUTLIER -5.77 -68.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 7' ' ' ASN . . . . . 0.825 ' N ' HG22 ' I' ' 6' ' ' VAL . 14.5 p30 -63.4 -46.09 88.04 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.658 -1.276 . . . . 0.0 110.214 -178.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 8' ' ' VAL . . . . . 0.814 HG12 ' O ' ' I' ' 5' ' ' PTR . 13.0 p -9.3 123.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 CA-C-O 121.07 0.462 . . . . 0.0 111.375 178.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 9' ' ' GLN . . . . . 0.464 ' O ' ' O ' ' I' ' 10' ' ' ASN . 10.9 pt20 -50.2 149.9 2.7 Favored 'General case' 0 C--N 1.297 -1.676 0 C-N-CA 118.885 -1.126 . . . . 0.0 109.408 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 10' ' ' ASN . . . . . 0.464 ' O ' ' O ' ' I' ' 9' ' ' GLN . 0.5 OUTLIER -43.03 166.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.401 -0.812 . . . . 0.0 109.464 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 11' ' ' LEU . . . . . 0.434 ' O ' ' C ' ' I' ' 12' ' ' ASP . 0.1 OUTLIER -76.8 3.84 11.01 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.189 -0.945 . . . . 0.0 109.844 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' I' I ' 12' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' I' ' 11' ' ' LEU . 2.0 m-20 -43.65 -40.41 4.12 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.156 -0.965 . . . . 0.0 109.289 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' I' I ' 13' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' I' ' 12' ' ' ASP . 5.7 mmtm . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.626 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 1 N-CA-C 137.377 9.711 . . . . 0.0 137.377 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.15 -147.83 0.13 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.249 -1.147 . . . . 0.0 109.452 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 3' ' ' HIS . . . . . 0.551 ' CD2' ' HB3' ' E' ' 6' ' ' PHE . 69.2 m80 -148.86 93.48 4.21 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.256 -0.902 . . . . 0.0 109.445 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 4' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -77.37 4.18 6.13 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.854 2.369 . . . . 0.0 110.659 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 5' ' ' TRP . . . . . 0.958 ' CZ3' HD12 ' E' ' 30' ' ' ILE . 29.0 p-90 -149.88 -37.8 0.15 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.309 -0.869 . . . . 0.0 109.377 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 6' ' ' PHE . . . . . 1.022 ' CE1' HG22 ' E' ' 30' ' ' ILE . 11.6 t80 -65.49 153.2 42.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.112 -0.993 . . . . 0.0 109.449 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 7' ' ' PHE . . . . . 0.84 ' HE2' HD22 ' E' ' 29' ' ' LEU . 1.1 m-85 -117.03 -68.74 0.9 Allowed 'General case' 0 C--N 1.298 -1.63 0 O-C-N 121.556 -0.715 . . . . 0.0 109.155 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 8' ' ' GLY . . . . . 0.509 ' O ' ' HB3' ' E' ' 32' ' ' GLU . . . 140.26 -97.05 0.22 Allowed Glycine 0 N--CA 1.487 2.059 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 9' ' ' LYS . . . . . 0.507 ' C ' ' HG2' ' E' ' 34' ' ' GLU . 0.1 OUTLIER -118.72 68.77 0.79 Allowed 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.154 -1.204 . . . . 0.0 110.447 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 10' ' ' ILE . . . . . 0.548 ' CG2' ' HB3' ' E' ' 7' ' ' PHE . 0.1 OUTLIER -119.88 168.03 11.14 Favored Pre-proline 0 C--N 1.303 -1.427 0 O-C-N 120.934 -1.103 . . . . 0.0 110.151 179.234 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 11' ' ' PRO . . . . . 0.551 ' HG2' ' HB2' ' E' ' 14' ' ' LYS . 32.4 Cg_endo -80.64 136.69 11.01 Favored 'Trans proline' 0 C--N 1.288 -2.628 0 C-N-CA 124.151 3.234 . . . . 0.0 111.121 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 12' ' ' ARG . . . . . 0.587 ' HA ' ' NE ' ' E' ' 31' ' ' ARG . 0.0 OUTLIER -49.62 -38.43 31.98 Favored 'General case' 0 C--N 1.302 -1.491 0 C-N-CA 119.035 -1.066 . . . . 0.0 108.137 178.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.84 -43.17 90.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.732 -0.605 . . . . 0.0 109.592 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 14' ' ' LYS . . . . . 0.551 ' HB2' ' HG2' ' E' ' 11' ' ' PRO . 10.4 tppt? -57.48 -41.47 80.75 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 15' ' ' ALA . . . . . 0.968 ' HB1' HD21 ' E' ' 29' ' ' LEU . . . -71.68 -22.92 61.59 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 16' ' ' GLU . . . . . 0.882 ' HA ' HG11 ' E' ' 50' ' ' VAL . 3.2 mt-10 -82.12 -11.6 58.66 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 17' ' ' GLU . . . . . 0.414 ' HB3' ' HE3' ' E' ' 18' ' ' MET . 1.7 mt-10 -93.81 -50.84 5.17 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 18' ' ' MET . . . . . 0.607 ' HA ' ' HE2' ' E' ' 18' ' ' MET . 26.9 mmt -65.37 -20.04 66.21 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 19' ' ' LEU . . . . . 0.875 HD21 ' CD1' ' E' ' 96' ' ' ILE . 11.3 mt -86.2 -23.39 26.5 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 119.647 -0.821 . . . . 0.0 109.061 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 20' ' ' SER . . . . . . . . . . . . . 23.3 t -73.38 -28.33 61.97 Favored 'General case' 0 C--N 1.297 -1.682 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.497 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 21' ' ' LYS . . . . . 0.584 ' HD2' ' HA ' ' E' ' 18' ' ' MET . 0.0 OUTLIER -91.12 -8.7 48.04 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 117.65 -1.62 . . . . 0.0 108.4 179.001 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 22' ' ' GLN . . . . . 0.626 ' CG ' ' CB ' ' E' ' 27' ' ' ALA . 0.8 OUTLIER -51.53 177.35 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.224 0 O-C-N 121.371 -0.83 . . . . 0.0 109.326 179.399 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 23' ' ' ARG . . . . . 0.646 ' CG ' ' CE1' ' E' ' 24' ' ' HIS . 1.3 ptm180 -130.51 -29.96 1.93 Allowed 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.257 -179.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 24' ' ' HIS . . . . . 0.646 ' CE1' ' CG ' ' E' ' 23' ' ' ARG . 6.6 m-70 -96.88 124.98 41.01 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 120.795 -1.191 . . . . 0.0 108.204 179.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 25' ' ' ASP . . . . . 0.539 ' HA ' ' HD2' ' E' ' 45' ' ' LYS . 0.4 OUTLIER -70.05 99.37 1.44 Allowed 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.724 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 26' ' ' GLY . . . . . 0.491 ' O ' ' C ' ' E' ' 27' ' ' ALA . . . 160.54 -26.6 0.3 Allowed Glycine 0 C--N 1.291 -1.96 0 N-CA-C 106.578 -2.609 . . . . 0.0 106.578 -177.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 27' ' ' ALA . . . . . 0.864 ' HB1' HG12 ' E' ' 96' ' ' ILE . . . -36.48 137.34 0.29 Allowed 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 178.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 28' ' ' PHE . . . . . 1.203 ' CG ' HD13 ' E' ' 93' ' ' LEU . 1.0 OUTLIER -148.32 162.16 40.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.668 -1.27 . . . . 0.0 111.76 -178.038 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 29' ' ' LEU . . . . . 0.968 HD21 ' HB1' ' E' ' 15' ' ' ALA . 4.5 pp -152.2 155.97 38.82 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 30' ' ' ILE . . . . . 1.022 HG22 ' CE1' ' E' ' 6' ' ' PHE . 3.9 mt -115.04 133.5 61.06 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.171 0 C-N-CA 117.53 -1.668 . . . . 0.0 109.713 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 31' ' ' ARG . . . . . 0.587 ' NE ' ' HA ' ' E' ' 12' ' ' ARG . 0.0 OUTLIER -116.09 145.43 43.04 Favored 'General case' 0 C--N 1.288 -2.103 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.829 -177.655 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 32' ' ' GLU . . . . . 0.509 ' HB3' ' O ' ' E' ' 8' ' ' GLY . 32.9 tt0 -96.62 57.66 1.62 Allowed 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.767 -0.583 . . . . 0.0 109.653 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 33' ' ' SER . . . . . 0.604 ' HB3' ' HB3' ' E' ' 36' ' ' ALA . 0.4 OUTLIER 34.53 94.84 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.913 -0.492 . . . . 0.0 110.48 -179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 34' ' ' GLU . . . . . 0.546 ' HG2' ' N ' ' E' ' 10' ' ' ILE . 1.2 mm-40 -68.53 -18.32 64.34 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.056 -1.028 . . . . 0.0 109.724 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 35' ' ' SER . . . . . . . . . . . . . 18.6 p -88.76 -27.68 20.99 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.209 -0.932 . . . . 0.0 109.164 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 36' ' ' ALA . . . . . 0.873 ' HB1' ' HD2' ' E' ' 37' ' ' PRO . . . -88.41 172.29 7.92 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.391 -0.818 . . . . 0.0 109.335 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 37' ' ' PRO . . . . . 0.873 ' HD2' ' HB1' ' E' ' 36' ' ' ALA . 33.8 Cg_endo -77.13 -3.99 14.33 Favored 'Trans proline' 0 C--N 1.304 -1.806 0 C-N-CA 122.381 2.054 . . . . 0.0 108.719 178.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 38' ' ' GLY . . . . . 0.499 ' HA2' ' HG2' ' E' ' 32' ' ' GLU . . . 152.85 69.63 0.01 OUTLIER Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 39' ' ' ASP . . . . . 0.545 ' CB ' ' HB2' ' E' ' 33' ' ' SER . 0.3 OUTLIER -113.0 110.96 21.35 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.41 -1.053 . . . . 0.0 108.892 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 40' ' ' PHE . . . . . 0.558 ' CB ' ' HB ' ' E' ' 55' ' ' VAL . 10.1 m-85 -58.2 157.6 8.11 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.11 -0.994 . . . . 0.0 110.544 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 41' ' ' SER . . . . . 0.532 ' HB2' ' NH1' ' E' ' 31' ' ' ARG . 3.8 m -170.71 -177.85 2.43 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 107.543 -1.281 . . . . 0.0 107.543 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 42' ' ' LEU . . . . . 0.817 HD12 ' N ' ' E' ' 43' ' ' SER . 0.1 OUTLIER -161.64 132.76 5.27 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.492 -1.38 . . . . 0.0 111.408 179.283 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 43' ' ' SER . . . . . 0.817 ' N ' HD12 ' E' ' 42' ' ' LEU . 1.5 m -102.39 149.45 24.35 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 44' ' ' VAL . . . . . 0.623 ' CG2' ' CE1' ' E' ' 46' ' ' PHE . 5.3 p -154.58 144.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.586 0 O-C-N 121.083 -1.011 . . . . 0.0 109.127 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 45' ' ' LYS . . . . . 0.539 ' HD2' ' HA ' ' E' ' 25' ' ' ASP . 1.6 ttmt -88.85 111.52 22.15 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-O 121.169 0.509 . . . . 0.0 111.006 -178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 46' ' ' PHE . . . . . 1.099 ' CZ ' HG21 ' E' ' 85' ' ' VAL . 13.5 m-30 -112.51 95.03 5.21 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.313 -0.867 . . . . 0.0 109.57 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 47' ' ' GLY . . . . . 0.547 ' O ' ' CB ' ' E' ' 48' ' ' ASN . . . 94.56 -35.97 3.98 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.007 -1.637 . . . . 0.0 109.007 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 48' ' ' ASN . . . . . 0.547 ' CB ' ' O ' ' E' ' 47' ' ' GLY . 6.3 t30 158.47 -23.33 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 49' ' ' ASP . . . . . 0.488 ' O ' ' HA ' ' E' ' 45' ' ' LYS . 3.1 m-20 -85.35 171.98 11.44 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 50' ' ' VAL . . . . . 0.882 HG11 ' HA ' ' E' ' 16' ' ' GLU . 34.9 t -120.29 96.96 4.63 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 C-N-CA 118.433 -1.307 . . . . 0.0 111.049 -178.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 51' ' ' GLN . . . . . 0.719 ' HG2' HG12 ' I' ' 6' ' ' VAL . 0.0 OUTLIER -96.02 144.05 26.65 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 178.187 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 52' ' ' HIS . . . . . 0.556 ' HB3' ' O ' ' E' ' 42' ' ' LEU . 0.0 OUTLIER -122.45 153.97 38.4 Favored 'General case' 0 C--N 1.295 -1.777 0 O-C-N 120.996 -1.065 . . . . 0.0 110.59 -179.053 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 53' ' ' PHE . . . . . 0.754 ' HE1' HG21 ' I' ' 6' ' ' VAL . 45.3 m-85 -104.43 139.79 38.86 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 54' ' ' LYS . . . . . 0.574 ' HD3' ' CE2' ' I' ' 5' ' ' PTR . 8.9 tptm -79.56 133.19 36.45 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 118.56 -1.256 . . . . 0.0 107.874 177.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 55' ' ' VAL . . . . . 0.889 ' C ' HD23 ' E' ' 56' ' ' LEU . 57.0 t -97.26 133.4 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 56' ' ' LEU . . . . . 0.889 HD23 ' C ' ' E' ' 55' ' ' VAL . 0.1 OUTLIER -124.7 174.06 8.13 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.284 -0.885 . . . . 0.0 109.624 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 57' ' ' ARG . . . . . 0.65 ' CD ' ' CE1' ' E' ' 63' ' ' TYR . 2.2 tpp85 -125.1 138.65 54.17 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.439 -0.788 . . . . 0.0 109.213 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 58' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -73.54 -0.32 14.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.228 -0.92 . . . . 0.0 109.739 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.77 -5.91 83.24 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 60' ' ' ALA . . . . . . . . . . . . . . . -114.94 -18.56 11.24 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.288 -1.125 . . . . 0.0 109.143 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 61' ' ' GLY . . . . . . . . . . . . . . . 132.05 -0.09 4.79 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.835 -1.306 . . . . 0.0 109.835 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 62' ' ' LYS . . . . . . . . . . . . . 4.4 mttp -77.97 161.18 27.71 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.125 -1.221 . . . . 0.0 109.539 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 63' ' ' TYR . . . . . 0.797 ' O ' HD11 ' E' ' 76' ' ' LEU . 83.7 m-85 -133.74 131.27 39.2 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.237 -0.914 . . . . 0.0 109.723 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 64' ' ' PHE . . . . . 0.772 ' HA ' HD21 ' E' ' 76' ' ' LEU . 0.1 OUTLIER -137.59 172.5 12.87 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.114 -0.991 . . . . 0.0 109.221 178.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 65' ' ' LEU . . . . . 0.783 HD22 HG22 ' E' ' 55' ' ' VAL . 0.5 OUTLIER -176.41 57.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.858 -1.151 . . . . 0.0 110.044 179.185 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 66' ' ' TRP . . . . . 0.712 ' HB2' ' O ' ' E' ' 65' ' ' LEU . 0.0 OUTLIER 159.18 -78.01 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 177.643 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 67' ' ' VAL . . . . . . . . . . . . . 3.0 t -133.58 -74.02 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 120.896 -1.128 . . . . 0.0 110.365 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 68' ' ' VAL . . . . . . . . . . . . . 20.9 t -80.99 153.9 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.016 -1.052 . . . . 0.0 109.904 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 69' ' ' LYS . . . . . 0.577 ' O ' ' CD1' ' E' ' 70' ' ' PHE . 1.3 pttt -110.47 -177.22 3.18 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.347 -0.846 . . . . 0.0 109.375 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 70' ' ' PHE . . . . . 0.577 ' CD1' ' O ' ' E' ' 69' ' ' LYS . 67.0 m-85 -153.55 -167.52 2.71 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.218 -0.926 . . . . 0.0 109.954 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 71' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.53 10.39 12.58 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.449 -0.782 . . . . 0.0 109.129 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 72' ' ' SER . . . . . 0.635 ' O ' HD12 ' E' ' 76' ' ' LEU . 0.3 OUTLIER -156.01 151.55 27.02 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 121.199 -0.938 . . . . 0.0 109.896 179.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 73' ' ' LEU . . . . . 0.623 HD23 ' N ' ' E' ' 73' ' ' LEU . 1.3 mt -66.67 -64.24 0.9 Allowed 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 74' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -21.92 5.8 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 75' ' ' GLU . . . . . 0.547 ' CG ' ' HB3' ' E' ' 72' ' ' SER . 4.0 mm-40 -67.02 -46.56 74.1 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 178.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 76' ' ' LEU . . . . . 0.797 HD11 ' O ' ' E' ' 63' ' ' TYR . 0.5 OUTLIER -63.17 -27.88 69.67 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 178.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 77' ' ' VAL . . . . . 0.685 HG13 ' CE2' ' E' ' 28' ' ' PHE . 62.2 t -66.95 -66.96 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 78' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' E' ' 81' ' ' ARG . 3.7 m-20 -46.36 -43.8 16.4 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.764 -0.585 . . . . 0.0 109.719 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 79' ' ' TYR . . . . . 0.548 ' CG ' ' CZ ' ' E' ' 70' ' ' PHE . 2.9 t80 -57.23 -58.23 9.11 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.001 -1.062 . . . . 0.0 109.195 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 80' ' ' HIS . . . . . 0.483 ' CD2' ' CE2' ' E' ' 79' ' ' TYR . 1.5 m170 -71.03 -4.37 24.6 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.486 -0.759 . . . . 0.0 109.454 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 81' ' ' ARG . . . . . 0.497 ' HG3' HG12 ' E' ' 77' ' ' VAL . 5.1 mtm180 -80.4 -24.52 39.63 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.85 -16.79 13.48 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 83' ' ' THR . . . . . 0.554 ' C ' ' CE2' ' E' ' 92' ' ' PHE . 10.2 m -110.09 137.03 48.4 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 84' ' ' SER . . . . . 0.523 ' N ' ' CE2' ' E' ' 92' ' ' PHE . 0.2 OUTLIER -52.55 -170.55 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.259 -0.901 . . . . 0.0 110.185 -179.345 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 85' ' ' VAL . . . . . 1.099 HG21 ' CZ ' ' E' ' 46' ' ' PHE . 0.4 OUTLIER -138.93 -36.62 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 O-C-N 121.564 -0.71 . . . . 0.0 109.506 -179.339 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 86' ' ' SER . . . . . . . . . . . . . 3.7 t -114.5 150.65 34.53 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.407 -0.808 . . . . 0.0 109.551 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.9 12.19 6.53 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.262 -0.898 . . . . 0.0 109.668 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 88' ' ' ASN . . . . . 0.48 ' O ' ' HG3' ' E' ' 89' ' ' GLN . 5.2 t30 -103.41 -26.92 12.71 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -0.938 . . . . 0.0 109.423 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 89' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' E' ' 88' ' ' ASN . 25.8 mt-30 -153.79 -172.92 4.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 109.329 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.69 80.85 1.36 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.187 -0.946 . . . . 0.0 109.631 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 91' ' ' ILE . . . . . 1.051 HG21 ' CD1' ' E' ' 46' ' ' PHE . 1.3 mt -105.12 153.9 6.67 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.093 -1.004 . . . . 0.0 108.869 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 92' ' ' PHE . . . . . 0.554 ' CE2' ' C ' ' E' ' 83' ' ' THR . 7.3 m-85 -142.78 157.66 44.41 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.105 -0.997 . . . . 0.0 109.587 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 93' ' ' LEU . . . . . 1.203 HD13 ' CG ' ' E' ' 28' ' ' PHE . 0.2 OUTLIER -61.59 139.0 58.33 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.105 -0.997 . . . . 0.0 108.95 179.307 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 94' ' ' ARG . . . . . 0.55 ' HB2' ' HA ' ' E' ' 27' ' ' ALA . 0.2 OUTLIER -137.97 -173.91 3.64 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.186 -0.946 . . . . 0.0 109.554 179.725 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 95' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -89.2 134.54 33.99 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.866 -1.146 . . . . 0.0 110.24 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' E' E ' 96' ' ' ILE . . . . . 0.875 ' CD1' HD21 ' E' ' 19' ' ' LEU . 20.4 mt -113.02 157.11 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.192 -0.943 . . . . 0.0 110.7 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 97' ' ' GLU . . . . . 0.537 ' O ' ' O ' ' E' ' 96' ' ' ILE . 0.0 OUTLIER 41.34 -175.93 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 CA-C-O 121.743 0.782 . . . . 0.0 111.066 177.625 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 98' ' ' GLN . . . . . 0.604 ' O ' ' O ' ' E' ' 99' ' ' VAL . 3.4 mt-30 73.99 -14.05 0.71 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.469 -0.769 . . . . 0.0 111.659 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 99' ' ' VAL . . . . . 0.697 ' HB ' ' HD2' ' E' ' 100' ' ' PRO . 14.2 m 48.12 169.47 0.02 OUTLIER Pre-proline 0 N--CA 1.502 2.131 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -178.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 100' ' ' PRO . . . . . 0.697 ' HD2' ' HB ' ' E' ' 99' ' ' VAL . 30.2 Cg_endo -74.47 78.46 2.7 Favored 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 121.156 1.237 . . . . 0.0 111.945 -177.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 101' ' ' GLN . . . . . 0.577 ' O ' ' CB ' ' E' ' 102' ' ' GLN . 0.8 OUTLIER 1.1 112.33 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.481 0 C-N-CA 123.252 0.621 . . . . 0.0 111.42 179.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 102' ' ' GLN . . . . . 0.763 ' N ' ' CD ' ' E' ' 103' ' ' PRO . 0.7 OUTLIER 98.69 10.73 0.0 OUTLIER Pre-proline 0 N--CA 1.499 2.005 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.49 -178.263 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' E' E ' 103' ' ' PRO . . . . . 0.763 ' CD ' ' N ' ' E' ' 102' ' ' GLN . 41.5 Cg_endo -81.39 73.64 5.8 Favored 'Trans proline' 0 N--CA 1.479 0.657 0 C-N-CA 121.09 1.193 . . . . 0.0 110.295 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' E' E ' 104' ' ' THR . . . . . 0.438 HG23 ' C ' ' E' ' 103' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 117.866 -1.064 . . . . 0.0 109.876 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 1' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' I' I ' 2' ' ' ASP . . . . . 0.429 ' N ' ' OD1' ' I' ' 2' ' ' ASP . 0.5 OUTLIER -107.44 138.3 19.9 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.239 -0.913 . . . . 0.0 109.382 -179.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 3' ' ' PRO . . . . . 0.567 ' CG ' ' HD2' ' E' ' 12' ' ' ARG . 37.1 Cg_endo -80.12 -21.5 7.9 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 C-N-CA 122.595 2.196 . . . . 0.0 110.311 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 4' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' I' ' 3' ' ' PRO . 3.0 m 77.53 -177.27 0.11 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.502 -0.749 . . . . 0.0 109.116 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 5' ' ' PTR . . . . . 0.814 ' O ' HG12 ' I' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' I' I ' 6' ' ' VAL . . . . . 0.825 HG22 ' N ' ' I' ' 7' ' ' ASN . 0.2 OUTLIER -5.77 -68.82 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 7' ' ' ASN . . . . . 0.825 ' N ' HG22 ' I' ' 6' ' ' VAL . 14.5 p30 -63.4 -46.09 88.04 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.658 -1.276 . . . . 0.0 110.214 -178.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 8' ' ' VAL . . . . . 0.814 HG12 ' O ' ' I' ' 5' ' ' PTR . 13.0 p -9.3 123.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 CA-C-O 121.07 0.462 . . . . 0.0 111.375 178.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 9' ' ' GLN . . . . . 0.464 ' O ' ' O ' ' I' ' 10' ' ' ASN . 10.9 pt20 -50.2 149.9 2.7 Favored 'General case' 0 C--N 1.297 -1.676 0 C-N-CA 118.885 -1.126 . . . . 0.0 109.408 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 10' ' ' ASN . . . . . 0.464 ' O ' ' O ' ' I' ' 9' ' ' GLN . 0.5 OUTLIER -43.03 166.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.401 -0.812 . . . . 0.0 109.464 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 11' ' ' LEU . . . . . 0.434 ' O ' ' C ' ' I' ' 12' ' ' ASP . 0.1 OUTLIER -76.8 3.84 11.01 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.189 -0.945 . . . . 0.0 109.844 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' I' I ' 12' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' I' ' 11' ' ' LEU . 2.0 m-20 -43.65 -40.41 4.12 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.156 -0.965 . . . . 0.0 109.289 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' I' I ' 13' ' ' LYS . . . . . 0.434 ' O ' ' O ' ' I' ' 12' ' ' ASP . 5.7 mmtm . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.626 179.853 . . . . . . . . 1 1 . 1 stop_ save_