data_1i8e_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 1i8e _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 core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 121.205 0.526 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.466 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -117.92 78.86 1.29 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.728 -0.608 . . . . 0.0 109.927 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 m -79.08 -172.31 3.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.744 -0.598 . . . . 0.0 110.447 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.6 mt -107.15 19.04 20.94 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.547 -0.72 . . . . 0.0 111.049 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.436 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -116.23 -64.92 1.24 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.275 -0.89 . . . . 0.0 109.255 179.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -156.63 18.77 0.43 Allowed Glycine 0 N--CA 1.49 2.261 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.886 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -109.0 138.19 45.73 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-N 118.782 1.291 . . . . 0.0 110.11 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 172.22 47.71 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.5 p90 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.468 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.458 ' CA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -88.59 82.01 6.98 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.826 0.822 . . . . 0.0 109.975 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.6 m -77.43 -168.84 1.24 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.845 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -93.42 8.49 40.33 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.692 -0.63 . . . . 0.0 111.655 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 5' ' ' SER . 16.7 mtm180 -96.46 -25.98 15.47 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.144 -0.972 . . . . 0.0 109.066 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 129.55 26.72 0.85 Allowed Glycine 0 N--CA 1.488 2.165 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 t70 -100.44 -170.57 1.88 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.031 -1.276 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.458 ' HA ' ' CA ' ' A' ' 4' ' ' CYS . 0.2 OUTLIER 176.25 -31.23 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.747 -0.596 . . . . 0.0 110.868 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 51.8 p90 . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.506 -0.746 . . . . 0.0 110.922 -179.836 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 121.184 0.516 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m -92.28 96.82 10.51 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 120.033 -0.667 . . . . 0.0 109.591 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.5 m -104.82 -162.09 0.86 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.741 -0.599 . . . . 0.0 110.887 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.6 mt -100.59 -24.9 14.34 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.342 -0.543 . . . . 0.0 111.514 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -72.62 -15.46 61.73 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.328 -0.857 . . . . 0.0 110.758 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.49 4.82 2.72 Favored Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.476 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.47 155.92 31.41 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 119.195 1.498 . . . . 0.0 109.555 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 169.35 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.376 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 16.0 p90 . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 N--CA 1.495 1.778 0 CA-C-O 120.913 0.387 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -128.98 91.46 3.21 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.459 0.647 . . . . 0.0 109.883 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.71 145.84 50.77 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.171 0.51 . . . . 0.0 110.513 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.74 65.33 2.47 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.931 0.872 . . . . 0.0 110.04 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.01 -41.26 0.09 Allowed 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 176.35 26.31 0.03 OUTLIER Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.594 -1.289 . . . . 0.0 112.064 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 18.1 p-10 -150.74 146.55 26.5 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 119.762 1.781 . . . . 0.0 110.961 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER 171.59 52.11 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.414 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 53.0 p90 . . . . . 0 C--N 1.3 -1.551 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 t80 . . . . . 0 N--CA 1.495 1.784 0 CA-C-O 121.432 0.634 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.3 m -89.51 83.56 6.35 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.62 0.724 . . . . 0.0 109.792 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 21.6 m -76.78 -173.61 2.7 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.19 0.519 . . . . 0.0 110.663 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -98.9 -12.25 20.92 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.657 -0.652 . . . . 0.0 111.473 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.5 mtm180 -72.76 -60.68 2.12 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.59 34.22 0.04 OUTLIER Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.4 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 8.7 t70 -113.17 153.43 28.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.171 -1.193 . . . . 0.0 110.089 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -173.78 29.93 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.793 -0.567 . . . . 0.0 109.651 179.72 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.8 p90 . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.621 -0.674 . . . . 0.0 109.232 -179.989 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.042 0.449 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 8.3 t -111.73 93.6 4.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.672 -0.643 . . . . 0.0 109.4 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 0.4 OUTLIER -127.64 -165.89 1.54 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.508 0.67 . . . . 0.0 112.052 -178.982 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.8 mt -86.36 -10.36 54.52 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 5.7 ptp180 -71.45 -17.54 62.36 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.998 -1.064 . . . . 0.0 109.891 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.48 25.0 3.02 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' ' 10' ' ' CYS . 15.3 p-10 -113.12 160.5 18.14 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.238 -1.154 . . . . 0.0 109.475 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 5.4 t 171.34 44.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.471 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.0 p90 . . . . . 0 C--N 1.298 -1.66 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.231 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 121.254 0.55 . . . . 0.0 110.681 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.7 m -88.11 81.36 7.42 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 121.577 0.703 . . . . 0.0 109.869 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.4 p -77.92 -166.81 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.186 0.517 . . . . 0.0 110.999 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.39 -16.96 17.44 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.649 -0.657 . . . . 0.0 111.914 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -72.54 -10.54 59.91 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.159 -0.963 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.84 21.7 3.8 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 110.207 -1.157 . . . . 0.0 110.207 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.1 t70 -99.86 157.38 16.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.238 . . . . 0.0 109.694 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.45 28.18 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.768 -0.582 . . . . 0.0 110.064 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.1 p90 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.701 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 121.086 0.47 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.8 m -91.65 81.1 5.31 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.871 0.844 . . . . 0.0 109.646 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.5 m -77.29 -169.19 1.31 Allowed 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.258 -179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 mp -104.08 4.11 33.94 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.704 -0.623 . . . . 0.0 111.954 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.409 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -95.99 -8.73 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.17 -0.956 . . . . 0.0 110.001 179.08 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 122.07 17.94 3.6 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.409 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.4 m-20 -100.58 157.87 16.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.961 -1.317 . . . . 0.0 109.589 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -173.6 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.818 -0.551 . . . . 0.0 110.18 179.827 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.3 p90 . . . . . 0 N--CA 1.49 1.535 0 O-C-N 121.556 -0.715 . . . . 0.0 109.534 179.548 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.012 0.434 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -104.11 76.72 1.37 Allowed 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.588 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.4 p -76.18 155.38 34.59 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.94 41.58 1.07 Allowed 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.143 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.41 ' CZ ' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -152.62 14.43 0.56 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.709 -0.797 . . . . 0.0 111.571 179.014 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 139.29 16.86 0.54 Allowed Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.036 -1.554 . . . . 0.0 113.922 177.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.1 t0 -142.99 152.43 41.94 Favored 'General case' 0 N--CA 1.508 2.45 0 CA-C-N 120.873 2.336 . . . . 0.0 112.51 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -175.87 30.83 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.276 0.56 . . . . 0.0 110.259 178.821 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 34.7 p90 . . . . . 0 N--CA 1.49 1.554 0 O-C-N 121.485 -0.759 . . . . 0.0 109.526 179.084 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 121.298 0.57 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.6 m -90.37 80.08 6.2 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.537 0.684 . . . . 0.0 110.058 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.7 p -77.66 -169.84 1.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.906 -0.496 . . . . 0.0 110.494 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.5 mt -102.48 -13.9 17.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.686 -0.634 . . . . 0.0 111.393 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -10.14 59.48 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.244 -0.91 . . . . 0.0 110.029 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.13 33.28 1.15 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.276 -1.13 . . . . 0.0 110.276 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -117.46 157.07 26.89 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.158 -1.201 . . . . 0.0 110.064 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.79 29.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.257 0.551 . . . . 0.0 109.884 179.607 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.772 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.3 t80 . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.274 0.559 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 15.6 m -81.05 83.26 6.78 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.556 0.693 . . . . 0.0 110.03 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 m -77.4 -170.81 1.89 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.253 0.549 . . . . 0.0 110.626 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.43 -15.51 19.61 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.563 -0.71 . . . . 0.0 111.695 -179.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.54 -10.78 60.07 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.15 -0.969 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.76 36.79 0.95 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.4 OUTLIER -118.35 166.9 12.09 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.32 -1.106 . . . . 0.0 110.4 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -174.59 26.13 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 CA-C-O 121.168 0.508 . . . . 0.0 110.117 179.307 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 49.2 p90 . . . . . 0 N--CA 1.488 1.425 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 179.728 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.237 0.542 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 38.2 t -107.13 90.15 3.21 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 m -75.79 -170.06 1.23 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mt -112.58 34.5 4.32 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.496 -0.752 . . . . 0.0 110.883 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.32 16.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 119.559 -0.857 . . . . 0.0 112.155 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.24 -1.48 1.44 Allowed Glycine 0 N--CA 1.499 2.872 0 C-N-CA 119.013 -1.565 . . . . 0.0 112.872 178.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -113.35 147.77 37.03 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 119.857 1.828 . . . . 0.0 111.136 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.19 41.1 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.326 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 p90 . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.83 -0.544 . . . . 0.0 109.631 -179.669 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.8 t80 . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.385 0.612 . . . . 0.0 111.503 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.2 m -101.32 81.83 2.25 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.621 0.724 . . . . 0.0 109.871 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 t -77.47 -169.62 1.5 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.929 -0.482 . . . . 0.0 110.897 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.5 mt -104.23 -3.63 24.07 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.663 -0.648 . . . . 0.0 111.886 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.42 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -90.46 -7.87 51.96 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.198 -0.939 . . . . 0.0 110.247 179.277 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.71 3.79 5.41 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.4 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 9.5 m-20 -83.22 149.57 26.74 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 118.959 1.379 . . . . 0.0 109.875 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER 179.93 35.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.652 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.6 p90 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.659 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 121.318 0.58 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -108.61 80.58 1.36 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.434 0.635 . . . . 0.0 109.925 179.486 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.415 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 4.3 m -80.26 -168.19 1.59 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.736 -0.602 . . . . 0.0 110.556 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.5 mt -103.83 -14.59 15.98 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.676 -0.64 . . . . 0.0 111.258 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.415 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.4 mtm180 -72.9 -63.11 1.24 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.25 -0.906 . . . . 0.0 108.767 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.31 29.94 0.08 OUTLIER Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.894 -1.282 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -107.24 147.03 30.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.165 -1.197 . . . . 0.0 110.08 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.81 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.531 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -179.7 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.063 0.458 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 6.1 m -89.43 81.59 6.57 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.822 0.82 . . . . 0.0 109.866 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -77.63 -165.91 0.69 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.83 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mt -100.35 -18.3 16.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.659 -0.65 . . . . 0.0 111.776 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -72.82 -13.33 61.27 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.204 -0.935 . . . . 0.0 110.571 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.78 21.52 3.21 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 110.378 -1.089 . . . . 0.0 110.378 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 5.4 t70 -99.12 163.75 12.44 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.13 -1.218 . . . . 0.0 109.364 179.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.87 27.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.764 -0.585 . . . . 0.0 110.261 179.797 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 40.0 p90 . . . . . 0 N--CA 1.488 1.438 0 O-C-N 121.456 -0.777 . . . . 0.0 109.553 179.549 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.681 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 96.6 m -92.33 100.16 12.79 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.612 -0.68 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -145.4 143.16 29.93 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.557 -0.714 . . . . 0.0 111.375 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.466 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -117.92 78.86 1.29 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.728 -0.608 . . . . 0.0 109.927 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.6 m -79.08 -172.31 3.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.744 -0.598 . . . . 0.0 110.447 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.6 mt -107.15 19.04 20.94 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.547 -0.72 . . . . 0.0 111.049 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.436 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -116.23 -64.92 1.24 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.275 -0.89 . . . . 0.0 109.255 179.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -156.63 18.77 0.43 Allowed Glycine 0 N--CA 1.49 2.261 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.886 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -109.0 138.19 45.73 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-N 118.782 1.291 . . . . 0.0 110.11 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.466 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 172.22 47.71 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.5 p90 -169.43 -171.74 1.32 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.0 m -125.18 175.21 7.55 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.04 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.358 0 O-C-N 119.852 -1.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.679 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 74.5 m -127.66 47.82 2.33 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.556 -0.715 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -146.26 177.93 8.63 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.809 -0.557 . . . . 0.0 109.877 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.458 ' CA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -88.59 82.01 6.98 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.826 0.822 . . . . 0.0 109.975 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.6 m -77.43 -168.84 1.24 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.845 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -93.42 8.49 40.33 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.692 -0.63 . . . . 0.0 111.655 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 5' ' ' SER . 16.7 mtm180 -96.46 -25.98 15.47 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.144 -0.972 . . . . 0.0 109.066 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 129.55 26.72 0.85 Allowed Glycine 0 N--CA 1.488 2.165 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 t70 -100.44 -170.57 1.88 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.031 -1.276 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.458 ' HA ' ' CA ' ' A' ' 4' ' ' CYS . 0.2 OUTLIER 176.25 -31.23 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.747 -0.596 . . . . 0.0 110.868 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 51.8 p90 -126.83 175.64 7.88 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.506 -0.746 . . . . 0.0 110.922 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.7 t -92.03 71.67 5.51 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.711 -0.618 . . . . 0.0 110.07 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.37 0 O-C-N 119.871 -1.768 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.629 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.89 155.43 23.67 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.637 -0.665 . . . . 0.0 109.964 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -120.79 48.72 1.57 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.465 -0.772 . . . . 0.0 110.274 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.2 m -92.28 96.82 10.51 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 120.033 -0.667 . . . . 0.0 109.591 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.5 m -104.82 -162.09 0.86 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.741 -0.599 . . . . 0.0 110.887 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.6 mt -100.59 -24.9 14.34 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.342 -0.543 . . . . 0.0 111.514 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -72.62 -15.46 61.73 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.328 -0.857 . . . . 0.0 110.758 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.49 4.82 2.72 Favored Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.476 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.47 155.92 31.41 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 119.195 1.498 . . . . 0.0 109.555 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 169.35 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.376 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 16.0 p90 -112.97 74.64 0.87 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.6 m -50.38 151.73 2.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.836 -0.54 . . . . 0.0 111.259 -177.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.358 0 O-C-N 119.883 -1.76 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.633 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m -89.65 149.7 22.68 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.557 -0.714 . . . . 0.0 109.559 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -145.44 118.45 8.8 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.405 -0.809 . . . . 0.0 111.638 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -128.98 91.46 3.21 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.459 0.647 . . . . 0.0 109.883 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.71 145.84 50.77 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.171 0.51 . . . . 0.0 110.513 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.74 65.33 2.47 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.931 0.872 . . . . 0.0 110.04 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.01 -41.26 0.09 Allowed 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 176.35 26.31 0.03 OUTLIER Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.594 -1.289 . . . . 0.0 112.064 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 18.1 p-10 -150.74 146.55 26.5 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 119.762 1.781 . . . . 0.0 110.961 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.509 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER 171.59 52.11 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.414 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 53.0 p90 -168.79 126.68 1.03 Allowed 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.0 t -87.49 -46.97 9.12 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.346 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.344 0 O-C-N 119.887 -1.758 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.698 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 22.3 m -90.08 51.01 1.96 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.606 -0.684 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -146.6 163.1 36.91 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.564 -0.71 . . . . 0.0 111.302 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.3 m -89.51 83.56 6.35 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.62 0.724 . . . . 0.0 109.792 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 21.6 m -76.78 -173.61 2.7 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.19 0.519 . . . . 0.0 110.663 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -98.9 -12.25 20.92 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.657 -0.652 . . . . 0.0 111.473 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.5 mtm180 -72.76 -60.68 2.12 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.59 34.22 0.04 OUTLIER Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.4 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 8.7 t70 -113.17 153.43 28.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.171 -1.193 . . . . 0.0 110.089 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -173.78 29.93 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.793 -0.567 . . . . 0.0 109.651 179.72 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -171.14 -167.31 0.53 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.621 -0.674 . . . . 0.0 109.232 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.3 m -107.57 -59.72 1.79 Allowed 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.162 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.343 0 O-C-N 119.92 -1.737 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.628 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 62.6 m -77.81 -166.93 0.86 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.572 -0.705 . . . . 0.0 109.918 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -121.91 101.26 7.45 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.608 -0.683 . . . . 0.0 111.348 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 8.3 t -111.73 93.6 4.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.672 -0.643 . . . . 0.0 109.4 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 0.4 OUTLIER -127.64 -165.89 1.54 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.508 0.67 . . . . 0.0 112.052 -178.982 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.8 mt -86.36 -10.36 54.52 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 5.7 ptp180 -71.45 -17.54 62.36 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.998 -1.064 . . . . 0.0 109.891 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.48 25.0 3.02 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' ' 10' ' ' CYS . 15.3 p-10 -113.12 160.5 18.14 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.238 -1.154 . . . . 0.0 109.475 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 5.4 t 171.34 44.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.471 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -165.71 142.45 5.41 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.4 m -67.19 114.08 5.64 Favored 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.118 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.36 0 O-C-N 119.782 -1.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.683 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.65 49.38 1.54 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.561 -0.712 . . . . 0.0 110.079 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -146.6 167.8 22.85 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.727 -0.608 . . . . 0.0 110.681 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.7 m -88.11 81.36 7.42 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 121.577 0.703 . . . . 0.0 109.869 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.4 p -77.92 -166.81 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.186 0.517 . . . . 0.0 110.999 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.39 -16.96 17.44 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.649 -0.657 . . . . 0.0 111.914 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -72.54 -10.54 59.91 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.159 -0.963 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.84 21.7 3.8 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 110.207 -1.157 . . . . 0.0 110.207 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.1 t70 -99.86 157.38 16.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.238 . . . . 0.0 109.694 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.45 28.18 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.768 -0.582 . . . . 0.0 110.064 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -170.51 -167.67 0.62 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -104.36 115.13 29.84 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.851 -0.74 . . . . 0.0 109.818 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.334 0 O-C-N 119.821 -1.799 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.625 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 73.2 m -101.29 44.96 0.99 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.564 -0.71 . . . . 0.0 109.87 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -147.3 179.01 7.95 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.893 -0.504 . . . . 0.0 110.211 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.8 m -91.65 81.1 5.31 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.871 0.844 . . . . 0.0 109.646 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.5 m -77.29 -169.19 1.31 Allowed 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.258 -179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 mp -104.08 4.11 33.94 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.704 -0.623 . . . . 0.0 111.954 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.409 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -95.99 -8.73 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.17 -0.956 . . . . 0.0 110.001 179.08 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 122.07 17.94 3.6 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.409 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.4 m-20 -100.58 157.87 16.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.961 -1.317 . . . . 0.0 109.589 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -173.6 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.818 -0.551 . . . . 0.0 110.18 179.827 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -169.85 169.22 8.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.556 -0.715 . . . . 0.0 109.534 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 t -103.44 118.88 37.76 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.246 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.333 0 O-C-N 119.796 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.65 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 77.7 m -92.41 50.88 1.67 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.549 -0.719 . . . . 0.0 109.806 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -146.97 -179.72 7.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.817 -0.552 . . . . 0.0 110.165 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -104.11 76.72 1.37 Allowed 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.588 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.4 p -76.18 155.38 34.59 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.94 41.58 1.07 Allowed 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.143 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.41 ' CZ ' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -152.62 14.43 0.56 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.709 -0.797 . . . . 0.0 111.571 179.014 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 139.29 16.86 0.54 Allowed Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.036 -1.554 . . . . 0.0 113.922 177.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.41 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.1 t0 -142.99 152.43 41.94 Favored 'General case' 0 N--CA 1.508 2.45 0 CA-C-N 120.873 2.336 . . . . 0.0 112.51 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -175.87 30.83 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.276 0.56 . . . . 0.0 110.259 178.821 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -170.4 167.56 8.24 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.485 -0.759 . . . . 0.0 109.526 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.5 t -108.09 104.77 14.27 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.563 -0.711 . . . . 0.0 110.181 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.337 0 O-C-N 119.824 -1.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.648 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.83 54.67 1.15 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.622 -0.674 . . . . 0.0 110.077 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -145.93 168.91 19.69 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.522 -0.736 . . . . 0.0 110.858 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.6 m -90.37 80.08 6.2 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.537 0.684 . . . . 0.0 110.058 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.7 p -77.66 -169.84 1.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.906 -0.496 . . . . 0.0 110.494 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.5 mt -102.48 -13.9 17.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.686 -0.634 . . . . 0.0 111.393 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -10.14 59.48 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.244 -0.91 . . . . 0.0 110.029 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.13 33.28 1.15 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.276 -1.13 . . . . 0.0 110.276 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -117.46 157.07 26.89 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.158 -1.201 . . . . 0.0 110.064 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.79 29.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.257 0.551 . . . . 0.0 109.884 179.607 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -170.9 -166.74 0.5 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.63 95.39 6.19 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.952 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.34 0 O-C-N 119.871 -1.768 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.218 -0.582 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.6 54.31 0.75 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.479 -0.763 . . . . 0.0 109.748 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -145.94 170.21 17.07 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.612 -0.68 . . . . 0.0 110.607 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 15.6 m -81.05 83.26 6.78 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.556 0.693 . . . . 0.0 110.03 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 m -77.4 -170.81 1.89 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.253 0.549 . . . . 0.0 110.626 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.43 -15.51 19.61 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.563 -0.71 . . . . 0.0 111.695 -179.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.54 -10.78 60.07 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.15 -0.969 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.76 36.79 0.95 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.4 OUTLIER -118.35 166.9 12.09 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.32 -1.106 . . . . 0.0 110.4 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -174.59 26.13 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 CA-C-O 121.168 0.508 . . . . 0.0 110.117 179.307 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -170.42 -165.01 0.43 Allowed 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -95.37 -73.73 0.58 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.837 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.372 0 O-C-N 119.861 -1.774 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.218 -0.58 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.5 m -93.83 111.21 22.87 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.516 -0.74 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -145.3 131.37 19.33 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.543 -0.723 . . . . 0.0 110.999 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 38.2 t -107.13 90.15 3.21 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 m -75.79 -170.06 1.23 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mt -112.58 34.5 4.32 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.496 -0.752 . . . . 0.0 110.883 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.32 16.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 119.559 -0.857 . . . . 0.0 112.155 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.24 -1.48 1.44 Allowed Glycine 0 N--CA 1.499 2.872 0 C-N-CA 119.013 -1.565 . . . . 0.0 112.872 178.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -113.35 147.77 37.03 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 119.857 1.828 . . . . 0.0 111.136 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.19 41.1 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.326 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -171.03 -165.91 0.44 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.83 -0.544 . . . . 0.0 109.631 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -112.32 107.73 16.67 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 120.114 -0.635 . . . . 0.0 109.87 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.374 0 O-C-N 119.805 -1.81 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.666 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.6 m -83.02 96.88 8.48 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.602 -0.686 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -145.33 146.52 31.65 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.485 -0.76 . . . . 0.0 111.503 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 1.2 m -101.32 81.83 2.25 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.621 0.724 . . . . 0.0 109.871 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 t -77.47 -169.62 1.5 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.929 -0.482 . . . . 0.0 110.897 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.5 mt -104.23 -3.63 24.07 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.663 -0.648 . . . . 0.0 111.886 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.42 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -90.46 -7.87 51.96 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.198 -0.939 . . . . 0.0 110.247 179.277 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.71 3.79 5.41 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.4 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 9.5 m-20 -83.22 149.57 26.74 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 118.959 1.379 . . . . 0.0 109.875 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER 179.93 35.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.652 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.6 p90 -171.41 -170.9 0.87 Allowed 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.5 m -100.03 99.64 10.41 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 119.752 -0.779 . . . . 0.0 110.181 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.352 0 O-C-N 119.837 -1.789 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.623 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 m -91.53 123.53 35.02 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.58 -0.7 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -145.18 140.51 27.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.477 -0.764 . . . . 0.0 111.149 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -108.61 80.58 1.36 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.434 0.635 . . . . 0.0 109.925 179.486 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.415 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 4.3 m -80.26 -168.19 1.59 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.736 -0.602 . . . . 0.0 110.556 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.5 mt -103.83 -14.59 15.98 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.676 -0.64 . . . . 0.0 111.258 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.415 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.4 mtm180 -72.9 -63.11 1.24 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.25 -0.906 . . . . 0.0 108.767 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.31 29.94 0.08 OUTLIER Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.894 -1.282 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -107.24 147.03 30.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.165 -1.197 . . . . 0.0 110.08 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.81 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.531 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -171.11 -173.61 1.32 Allowed 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.0 m -103.04 139.98 37.88 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.728 -0.789 . . . . 0.0 110.1 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.376 0 O-C-N 119.931 -1.73 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.632 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 94.6 m -110.71 45.52 1.14 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.479 -0.763 . . . . 0.0 110.057 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -147.16 -172.96 4.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.87 -0.519 . . . . 0.0 110.302 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 6.1 m -89.43 81.59 6.57 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.822 0.82 . . . . 0.0 109.866 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -77.63 -165.91 0.69 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.83 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mt -100.35 -18.3 16.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.659 -0.65 . . . . 0.0 111.776 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -72.82 -13.33 61.27 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.204 -0.935 . . . . 0.0 110.571 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.78 21.52 3.21 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 110.378 -1.089 . . . . 0.0 110.378 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 5.4 t70 -99.12 163.75 12.44 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.13 -1.218 . . . . 0.0 109.364 179.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.87 27.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.764 -0.585 . . . . 0.0 110.261 179.797 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -169.98 174.66 5.44 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.456 -0.777 . . . . 0.0 109.553 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.4 t -105.8 -37.18 6.79 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.281 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.377 0 O-C-N 119.932 -1.73 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 121.205 0.526 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -117.92 78.86 1.29 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.728 -0.608 . . . . 0.0 109.927 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.402 ' HB3' ' NE ' ' A' ' 7' ' ' ARG . 5.6 m -79.08 -172.31 3.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.744 -0.598 . . . . 0.0 110.447 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.6 mt -107.15 19.04 20.94 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.547 -0.72 . . . . 0.0 111.049 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.427 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -116.23 -64.92 1.24 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.275 -0.89 . . . . 0.0 109.255 179.591 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -156.63 18.77 0.43 Allowed Glycine 0 N--CA 1.49 2.261 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.886 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -109.0 138.19 45.73 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-N 118.782 1.291 . . . . 0.0 110.11 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 172.22 47.71 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.5 p90 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.468 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.472 ' CA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -88.59 82.01 6.98 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.826 0.822 . . . . 0.0 109.975 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.6 m -77.43 -168.84 1.24 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.845 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -93.42 8.49 40.33 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.692 -0.63 . . . . 0.0 111.655 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.425 ' CZ ' ' HB2' ' A' ' 5' ' ' SER . 16.7 mtm180 -96.46 -25.98 15.47 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.144 -0.972 . . . . 0.0 109.066 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 129.55 26.72 0.85 Allowed Glycine 0 N--CA 1.488 2.165 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.461 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 t70 -100.44 -170.57 1.88 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.031 -1.276 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.472 ' HA ' ' CA ' ' A' ' 4' ' ' CYS . 0.2 OUTLIER 176.25 -31.23 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.747 -0.596 . . . . 0.0 110.868 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 51.8 p90 . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.506 -0.746 . . . . 0.0 110.922 -179.836 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 121.184 0.516 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.2 m -92.28 96.82 10.51 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 120.033 -0.667 . . . . 0.0 109.591 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.5 m -104.82 -162.09 0.86 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.741 -0.599 . . . . 0.0 110.887 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.6 mt -100.59 -24.9 14.34 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.342 -0.543 . . . . 0.0 111.514 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -72.62 -15.46 61.73 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.328 -0.857 . . . . 0.0 110.758 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.49 4.82 2.72 Favored Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.476 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.405 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -77.47 155.92 31.41 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 119.195 1.498 . . . . 0.0 109.555 179.655 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 169.35 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.376 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 16.0 p90 . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 N--CA 1.495 1.778 0 CA-C-O 120.913 0.387 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -128.98 91.46 3.21 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.459 0.647 . . . . 0.0 109.883 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.71 145.84 50.77 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.171 0.51 . . . . 0.0 110.513 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.74 65.33 2.47 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.931 0.872 . . . . 0.0 110.04 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.01 -41.26 0.09 Allowed 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 176.35 26.31 0.03 OUTLIER Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.594 -1.289 . . . . 0.0 112.064 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 18.1 p-10 -150.74 146.55 26.5 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 119.762 1.781 . . . . 0.0 110.961 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER 171.59 52.11 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.414 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 53.0 p90 . . . . . 0 C--N 1.3 -1.551 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 t80 . . . . . 0 N--CA 1.495 1.784 0 CA-C-O 121.432 0.634 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.3 m -89.51 83.56 6.35 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.62 0.724 . . . . 0.0 109.792 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 21.6 m -76.78 -173.61 2.7 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.19 0.519 . . . . 0.0 110.663 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -98.9 -12.25 20.92 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.657 -0.652 . . . . 0.0 111.473 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.5 mtm180 -72.76 -60.68 2.12 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.59 34.22 0.04 OUTLIER Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 8.7 t70 -113.17 153.43 28.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.171 -1.193 . . . . 0.0 110.089 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -173.78 29.93 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.793 -0.567 . . . . 0.0 109.651 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.8 p90 . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.621 -0.674 . . . . 0.0 109.232 -179.989 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.042 0.449 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 8.3 t -111.73 93.6 4.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.672 -0.643 . . . . 0.0 109.4 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 0.4 OUTLIER -127.64 -165.89 1.54 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.508 0.67 . . . . 0.0 112.052 -178.982 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.8 mt -86.36 -10.36 54.52 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 5.7 ptp180 -71.45 -17.54 62.36 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.998 -1.064 . . . . 0.0 109.891 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.48 25.0 3.02 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 15.3 p-10 -113.12 160.5 18.14 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.238 -1.154 . . . . 0.0 109.475 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 5.4 t 171.34 44.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.471 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.0 p90 . . . . . 0 C--N 1.298 -1.66 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.231 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 121.254 0.55 . . . . 0.0 110.681 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.7 m -88.11 81.36 7.42 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 121.577 0.703 . . . . 0.0 109.869 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.4 p -77.92 -166.81 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.186 0.517 . . . . 0.0 110.999 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.39 -16.96 17.44 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.649 -0.657 . . . . 0.0 111.914 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -72.54 -10.54 59.91 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.159 -0.963 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.84 21.7 3.8 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 110.207 -1.157 . . . . 0.0 110.207 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.1 t70 -99.86 157.38 16.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.238 . . . . 0.0 109.694 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.45 28.18 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.768 -0.582 . . . . 0.0 110.064 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.1 p90 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.701 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 121.086 0.47 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.8 m -91.65 81.1 5.31 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.871 0.844 . . . . 0.0 109.646 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.405 ' HB3' ' NE ' ' A' ' 7' ' ' ARG . 58.5 m -77.29 -169.19 1.31 Allowed 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.258 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 6' ' ' LEU . 5.2 mp -104.08 4.11 33.94 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.704 -0.623 . . . . 0.0 111.954 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.405 ' NE ' ' HB3' ' A' ' 5' ' ' SER . 0.1 OUTLIER -95.99 -8.73 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.17 -0.956 . . . . 0.0 110.001 179.08 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 122.07 17.94 3.6 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.4 m-20 -100.58 157.87 16.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.961 -1.317 . . . . 0.0 109.589 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -173.6 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.818 -0.551 . . . . 0.0 110.18 179.827 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.3 p90 . . . . . 0 N--CA 1.49 1.535 0 O-C-N 121.556 -0.715 . . . . 0.0 109.534 179.548 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.012 0.434 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -104.11 76.72 1.37 Allowed 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.588 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.4 p -76.18 155.38 34.59 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.94 41.58 1.07 Allowed 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.143 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -152.62 14.43 0.56 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.709 -0.797 . . . . 0.0 111.571 179.014 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 139.29 16.86 0.54 Allowed Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.036 -1.554 . . . . 0.0 113.922 177.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.1 t0 -142.99 152.43 41.94 Favored 'General case' 0 N--CA 1.508 2.45 0 CA-C-N 120.873 2.336 . . . . 0.0 112.51 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -175.87 30.83 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.276 0.56 . . . . 0.0 110.259 178.821 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 34.7 p90 . . . . . 0 N--CA 1.49 1.554 0 O-C-N 121.485 -0.759 . . . . 0.0 109.526 179.084 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 121.298 0.57 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.6 m -90.37 80.08 6.2 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.537 0.684 . . . . 0.0 110.058 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.7 p -77.66 -169.84 1.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.906 -0.496 . . . . 0.0 110.494 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.5 mt -102.48 -13.9 17.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.686 -0.634 . . . . 0.0 111.393 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -10.14 59.48 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.244 -0.91 . . . . 0.0 110.029 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.13 33.28 1.15 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.276 -1.13 . . . . 0.0 110.276 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.445 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -117.46 157.07 26.89 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.158 -1.201 . . . . 0.0 110.064 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.79 29.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.257 0.551 . . . . 0.0 109.884 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.772 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.3 t80 . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.274 0.559 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 15.6 m -81.05 83.26 6.78 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.556 0.693 . . . . 0.0 110.03 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 m -77.4 -170.81 1.89 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.253 0.549 . . . . 0.0 110.626 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.43 -15.51 19.61 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.563 -0.71 . . . . 0.0 111.695 -179.113 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.54 -10.78 60.07 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.15 -0.969 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.76 36.79 0.95 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.4 OUTLIER -118.35 166.9 12.09 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.32 -1.106 . . . . 0.0 110.4 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.59 26.13 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 CA-C-O 121.168 0.508 . . . . 0.0 110.117 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 49.2 p90 . . . . . 0 N--CA 1.488 1.425 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 179.728 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.237 0.542 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 38.2 t -107.13 90.15 3.21 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 m -75.79 -170.06 1.23 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mt -112.58 34.5 4.32 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.496 -0.752 . . . . 0.0 110.883 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.32 16.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 119.559 -0.857 . . . . 0.0 112.155 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.24 -1.48 1.44 Allowed Glycine 0 N--CA 1.499 2.872 0 C-N-CA 119.013 -1.565 . . . . 0.0 112.872 178.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.2 m-20 -113.35 147.77 37.03 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 119.857 1.828 . . . . 0.0 111.136 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.19 41.1 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.326 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 p90 . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.83 -0.544 . . . . 0.0 109.631 -179.669 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.8 t80 . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.385 0.612 . . . . 0.0 111.503 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.2 m -101.32 81.83 2.25 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.621 0.724 . . . . 0.0 109.871 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 t -77.47 -169.62 1.5 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.929 -0.482 . . . . 0.0 110.897 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.5 mt -104.23 -3.63 24.07 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.663 -0.648 . . . . 0.0 111.886 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.41 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -90.46 -7.87 51.96 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.198 -0.939 . . . . 0.0 110.247 179.277 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.71 3.79 5.41 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 9.5 m-20 -83.22 149.57 26.74 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 118.959 1.379 . . . . 0.0 109.875 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER 179.93 35.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.652 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.6 p90 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.659 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 121.318 0.58 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -108.61 80.58 1.36 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.434 0.635 . . . . 0.0 109.925 179.486 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.415 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 4.3 m -80.26 -168.19 1.59 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.736 -0.602 . . . . 0.0 110.556 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.5 mt -103.83 -14.59 15.98 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.676 -0.64 . . . . 0.0 111.258 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.415 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.4 mtm180 -72.9 -63.11 1.24 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.25 -0.906 . . . . 0.0 108.767 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.31 29.94 0.08 OUTLIER Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.894 -1.282 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.24 147.03 30.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.165 -1.197 . . . . 0.0 110.08 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.81 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.531 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -179.7 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.063 0.458 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 6.1 m -89.43 81.59 6.57 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.822 0.82 . . . . 0.0 109.866 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -77.63 -165.91 0.69 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.83 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mt -100.35 -18.3 16.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.659 -0.65 . . . . 0.0 111.776 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -72.82 -13.33 61.27 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.204 -0.935 . . . . 0.0 110.571 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.78 21.52 3.21 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 110.378 -1.089 . . . . 0.0 110.378 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 5.4 t70 -99.12 163.75 12.44 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.13 -1.218 . . . . 0.0 109.364 179.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.87 27.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.764 -0.585 . . . . 0.0 110.261 179.797 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 40.0 p90 . . . . . 0 N--CA 1.488 1.438 0 O-C-N 121.456 -0.777 . . . . 0.0 109.553 179.549 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.681 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 96.6 m -92.33 100.16 12.79 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.612 -0.68 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -145.4 143.16 29.93 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.557 -0.714 . . . . 0.0 111.375 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -117.92 78.86 1.29 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.728 -0.608 . . . . 0.0 109.927 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.402 ' HB3' ' NE ' ' A' ' 7' ' ' ARG . 5.6 m -79.08 -172.31 3.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.744 -0.598 . . . . 0.0 110.447 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.6 mt -107.15 19.04 20.94 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.547 -0.72 . . . . 0.0 111.049 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.427 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -116.23 -64.92 1.24 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.275 -0.89 . . . . 0.0 109.255 179.591 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -156.63 18.77 0.43 Allowed Glycine 0 N--CA 1.49 2.261 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.886 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -109.0 138.19 45.73 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-N 118.782 1.291 . . . . 0.0 110.11 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 172.22 47.71 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.5 p90 -169.43 -171.74 1.32 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.0 m -125.18 175.21 7.55 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.04 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.358 0 O-C-N 119.852 -1.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.679 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 74.5 m -127.66 47.82 2.33 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.556 -0.715 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -146.26 177.93 8.63 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.809 -0.557 . . . . 0.0 109.877 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.472 ' CA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -88.59 82.01 6.98 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.826 0.822 . . . . 0.0 109.975 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.6 m -77.43 -168.84 1.24 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.845 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -93.42 8.49 40.33 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.692 -0.63 . . . . 0.0 111.655 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.425 ' CZ ' ' HB2' ' A' ' 5' ' ' SER . 16.7 mtm180 -96.46 -25.98 15.47 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.144 -0.972 . . . . 0.0 109.066 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 129.55 26.72 0.85 Allowed Glycine 0 N--CA 1.488 2.165 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.461 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 t70 -100.44 -170.57 1.88 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.031 -1.276 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.472 ' HA ' ' CA ' ' A' ' 4' ' ' CYS . 0.2 OUTLIER 176.25 -31.23 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.747 -0.596 . . . . 0.0 110.868 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 51.8 p90 -126.83 175.64 7.88 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.506 -0.746 . . . . 0.0 110.922 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.7 t -92.03 71.67 5.51 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.711 -0.618 . . . . 0.0 110.07 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.37 0 O-C-N 119.871 -1.768 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.629 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.89 155.43 23.67 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.637 -0.665 . . . . 0.0 109.964 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -120.79 48.72 1.57 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.465 -0.772 . . . . 0.0 110.274 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.2 m -92.28 96.82 10.51 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 120.033 -0.667 . . . . 0.0 109.591 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.5 m -104.82 -162.09 0.86 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.741 -0.599 . . . . 0.0 110.887 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.6 mt -100.59 -24.9 14.34 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.342 -0.543 . . . . 0.0 111.514 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -72.62 -15.46 61.73 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.328 -0.857 . . . . 0.0 110.758 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.49 4.82 2.72 Favored Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.476 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -77.47 155.92 31.41 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 119.195 1.498 . . . . 0.0 109.555 179.655 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 169.35 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.376 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 16.0 p90 -112.97 74.64 0.87 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.6 m -50.38 151.73 2.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.836 -0.54 . . . . 0.0 111.259 -177.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.358 0 O-C-N 119.883 -1.76 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.633 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m -89.65 149.7 22.68 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.557 -0.714 . . . . 0.0 109.559 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -145.44 118.45 8.8 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.405 -0.809 . . . . 0.0 111.638 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -128.98 91.46 3.21 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.459 0.647 . . . . 0.0 109.883 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.71 145.84 50.77 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.171 0.51 . . . . 0.0 110.513 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.74 65.33 2.47 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.931 0.872 . . . . 0.0 110.04 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.01 -41.26 0.09 Allowed 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 176.35 26.31 0.03 OUTLIER Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.594 -1.289 . . . . 0.0 112.064 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 18.1 p-10 -150.74 146.55 26.5 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 119.762 1.781 . . . . 0.0 110.961 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER 171.59 52.11 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.414 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 53.0 p90 -168.79 126.68 1.03 Allowed 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.0 t -87.49 -46.97 9.12 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.346 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.344 0 O-C-N 119.887 -1.758 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.698 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 22.3 m -90.08 51.01 1.96 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.606 -0.684 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -146.6 163.1 36.91 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.564 -0.71 . . . . 0.0 111.302 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.3 m -89.51 83.56 6.35 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.62 0.724 . . . . 0.0 109.792 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 21.6 m -76.78 -173.61 2.7 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.19 0.519 . . . . 0.0 110.663 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -98.9 -12.25 20.92 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.657 -0.652 . . . . 0.0 111.473 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.5 mtm180 -72.76 -60.68 2.12 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.59 34.22 0.04 OUTLIER Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 8.7 t70 -113.17 153.43 28.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.171 -1.193 . . . . 0.0 110.089 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -173.78 29.93 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.793 -0.567 . . . . 0.0 109.651 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -171.14 -167.31 0.53 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.621 -0.674 . . . . 0.0 109.232 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.3 m -107.57 -59.72 1.79 Allowed 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.162 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.343 0 O-C-N 119.92 -1.737 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.628 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 62.6 m -77.81 -166.93 0.86 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.572 -0.705 . . . . 0.0 109.918 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -121.91 101.26 7.45 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.608 -0.683 . . . . 0.0 111.348 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 8.3 t -111.73 93.6 4.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.672 -0.643 . . . . 0.0 109.4 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 0.4 OUTLIER -127.64 -165.89 1.54 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.508 0.67 . . . . 0.0 112.052 -178.982 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.8 mt -86.36 -10.36 54.52 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 5.7 ptp180 -71.45 -17.54 62.36 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.998 -1.064 . . . . 0.0 109.891 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.48 25.0 3.02 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 15.3 p-10 -113.12 160.5 18.14 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.238 -1.154 . . . . 0.0 109.475 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 5.4 t 171.34 44.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.471 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -165.71 142.45 5.41 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.4 m -67.19 114.08 5.64 Favored 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.118 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.36 0 O-C-N 119.782 -1.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.683 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.65 49.38 1.54 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.561 -0.712 . . . . 0.0 110.079 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -146.6 167.8 22.85 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.727 -0.608 . . . . 0.0 110.681 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.7 m -88.11 81.36 7.42 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 121.577 0.703 . . . . 0.0 109.869 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.4 p -77.92 -166.81 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.186 0.517 . . . . 0.0 110.999 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.39 -16.96 17.44 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.649 -0.657 . . . . 0.0 111.914 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -72.54 -10.54 59.91 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.159 -0.963 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.84 21.7 3.8 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 110.207 -1.157 . . . . 0.0 110.207 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.1 t70 -99.86 157.38 16.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.238 . . . . 0.0 109.694 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.45 28.18 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.768 -0.582 . . . . 0.0 110.064 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -170.51 -167.67 0.62 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -104.36 115.13 29.84 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.851 -0.74 . . . . 0.0 109.818 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.334 0 O-C-N 119.821 -1.799 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.625 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 73.2 m -101.29 44.96 0.99 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.564 -0.71 . . . . 0.0 109.87 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -147.3 179.01 7.95 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.893 -0.504 . . . . 0.0 110.211 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.8 m -91.65 81.1 5.31 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.871 0.844 . . . . 0.0 109.646 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.405 ' HB3' ' NE ' ' A' ' 7' ' ' ARG . 58.5 m -77.29 -169.19 1.31 Allowed 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.258 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 6' ' ' LEU . 5.2 mp -104.08 4.11 33.94 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.704 -0.623 . . . . 0.0 111.954 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.405 ' NE ' ' HB3' ' A' ' 5' ' ' SER . 0.1 OUTLIER -95.99 -8.73 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.17 -0.956 . . . . 0.0 110.001 179.08 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 122.07 17.94 3.6 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.4 m-20 -100.58 157.87 16.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.961 -1.317 . . . . 0.0 109.589 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -173.6 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.818 -0.551 . . . . 0.0 110.18 179.827 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -169.85 169.22 8.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.556 -0.715 . . . . 0.0 109.534 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 t -103.44 118.88 37.76 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.246 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.333 0 O-C-N 119.796 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.65 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 77.7 m -92.41 50.88 1.67 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.549 -0.719 . . . . 0.0 109.806 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -146.97 -179.72 7.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.817 -0.552 . . . . 0.0 110.165 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -104.11 76.72 1.37 Allowed 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.588 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.4 p -76.18 155.38 34.59 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.94 41.58 1.07 Allowed 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.143 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -152.62 14.43 0.56 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.709 -0.797 . . . . 0.0 111.571 179.014 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 139.29 16.86 0.54 Allowed Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.036 -1.554 . . . . 0.0 113.922 177.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.1 t0 -142.99 152.43 41.94 Favored 'General case' 0 N--CA 1.508 2.45 0 CA-C-N 120.873 2.336 . . . . 0.0 112.51 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -175.87 30.83 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.276 0.56 . . . . 0.0 110.259 178.821 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -170.4 167.56 8.24 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.485 -0.759 . . . . 0.0 109.526 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.5 t -108.09 104.77 14.27 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.563 -0.711 . . . . 0.0 110.181 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.337 0 O-C-N 119.824 -1.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.648 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.83 54.67 1.15 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.622 -0.674 . . . . 0.0 110.077 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -145.93 168.91 19.69 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.522 -0.736 . . . . 0.0 110.858 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.6 m -90.37 80.08 6.2 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.537 0.684 . . . . 0.0 110.058 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.7 p -77.66 -169.84 1.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.906 -0.496 . . . . 0.0 110.494 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.5 mt -102.48 -13.9 17.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.686 -0.634 . . . . 0.0 111.393 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -10.14 59.48 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.244 -0.91 . . . . 0.0 110.029 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.13 33.28 1.15 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.276 -1.13 . . . . 0.0 110.276 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.445 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -117.46 157.07 26.89 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.158 -1.201 . . . . 0.0 110.064 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.79 29.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.257 0.551 . . . . 0.0 109.884 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -170.9 -166.74 0.5 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.63 95.39 6.19 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.952 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.34 0 O-C-N 119.871 -1.768 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.218 -0.582 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.6 54.31 0.75 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.479 -0.763 . . . . 0.0 109.748 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -145.94 170.21 17.07 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.612 -0.68 . . . . 0.0 110.607 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 15.6 m -81.05 83.26 6.78 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.556 0.693 . . . . 0.0 110.03 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 m -77.4 -170.81 1.89 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.253 0.549 . . . . 0.0 110.626 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.43 -15.51 19.61 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.563 -0.71 . . . . 0.0 111.695 -179.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.54 -10.78 60.07 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.15 -0.969 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.76 36.79 0.95 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.4 OUTLIER -118.35 166.9 12.09 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.32 -1.106 . . . . 0.0 110.4 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.59 26.13 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 CA-C-O 121.168 0.508 . . . . 0.0 110.117 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -170.42 -165.01 0.43 Allowed 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -95.37 -73.73 0.58 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.837 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.372 0 O-C-N 119.861 -1.774 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.218 -0.58 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.5 m -93.83 111.21 22.87 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.516 -0.74 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -145.3 131.37 19.33 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.543 -0.723 . . . . 0.0 110.999 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 38.2 t -107.13 90.15 3.21 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 m -75.79 -170.06 1.23 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mt -112.58 34.5 4.32 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.496 -0.752 . . . . 0.0 110.883 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.32 16.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 119.559 -0.857 . . . . 0.0 112.155 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.24 -1.48 1.44 Allowed Glycine 0 N--CA 1.499 2.872 0 C-N-CA 119.013 -1.565 . . . . 0.0 112.872 178.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.2 m-20 -113.35 147.77 37.03 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 119.857 1.828 . . . . 0.0 111.136 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.19 41.1 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.326 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -171.03 -165.91 0.44 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.83 -0.544 . . . . 0.0 109.631 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -112.32 107.73 16.67 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 120.114 -0.635 . . . . 0.0 109.87 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.374 0 O-C-N 119.805 -1.81 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.666 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.6 m -83.02 96.88 8.48 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.602 -0.686 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -145.33 146.52 31.65 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.485 -0.76 . . . . 0.0 111.503 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.2 m -101.32 81.83 2.25 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.621 0.724 . . . . 0.0 109.871 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 t -77.47 -169.62 1.5 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.929 -0.482 . . . . 0.0 110.897 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.5 mt -104.23 -3.63 24.07 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.663 -0.648 . . . . 0.0 111.886 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.41 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -90.46 -7.87 51.96 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.198 -0.939 . . . . 0.0 110.247 179.277 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.71 3.79 5.41 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 9.5 m-20 -83.22 149.57 26.74 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 118.959 1.379 . . . . 0.0 109.875 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER 179.93 35.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.652 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.6 p90 -171.41 -170.9 0.87 Allowed 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.5 m -100.03 99.64 10.41 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 119.752 -0.779 . . . . 0.0 110.181 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.352 0 O-C-N 119.837 -1.789 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.623 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 m -91.53 123.53 35.02 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.58 -0.7 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -145.18 140.51 27.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.477 -0.764 . . . . 0.0 111.149 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -108.61 80.58 1.36 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.434 0.635 . . . . 0.0 109.925 179.486 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.415 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 4.3 m -80.26 -168.19 1.59 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.736 -0.602 . . . . 0.0 110.556 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.5 mt -103.83 -14.59 15.98 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.676 -0.64 . . . . 0.0 111.258 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.415 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.4 mtm180 -72.9 -63.11 1.24 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.25 -0.906 . . . . 0.0 108.767 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.31 29.94 0.08 OUTLIER Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.894 -1.282 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.24 147.03 30.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.165 -1.197 . . . . 0.0 110.08 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.81 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.531 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -171.11 -173.61 1.32 Allowed 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.0 m -103.04 139.98 37.88 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.728 -0.789 . . . . 0.0 110.1 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.376 0 O-C-N 119.931 -1.73 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.632 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 94.6 m -110.71 45.52 1.14 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.479 -0.763 . . . . 0.0 110.057 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -147.16 -172.96 4.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.87 -0.519 . . . . 0.0 110.302 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 6.1 m -89.43 81.59 6.57 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.822 0.82 . . . . 0.0 109.866 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -77.63 -165.91 0.69 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.83 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mt -100.35 -18.3 16.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.659 -0.65 . . . . 0.0 111.776 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -72.82 -13.33 61.27 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.204 -0.935 . . . . 0.0 110.571 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.78 21.52 3.21 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 110.378 -1.089 . . . . 0.0 110.378 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 5.4 t70 -99.12 163.75 12.44 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.13 -1.218 . . . . 0.0 109.364 179.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.87 27.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.764 -0.585 . . . . 0.0 110.261 179.797 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -169.98 174.66 5.44 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.456 -0.777 . . . . 0.0 109.553 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.4 t -105.8 -37.18 6.79 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.281 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.377 0 O-C-N 119.932 -1.73 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 121.205 0.526 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -117.92 78.86 1.29 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.728 -0.608 . . . . 0.0 109.927 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.402 ' HB3' ' NE ' ' A' ' 7' ' ' ARG . 5.6 m -79.08 -172.31 3.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.744 -0.598 . . . . 0.0 110.447 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.6 mt -107.15 19.04 20.94 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.547 -0.72 . . . . 0.0 111.049 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.427 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -116.23 -64.92 1.24 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.275 -0.89 . . . . 0.0 109.255 179.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -156.63 18.77 0.43 Allowed Glycine 0 N--CA 1.49 2.261 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.886 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -109.0 138.19 45.73 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-N 118.782 1.291 . . . . 0.0 110.11 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 172.22 47.71 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.5 p90 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.468 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 . . . . . 0 N--CA 1.493 1.707 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.472 ' CA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -88.59 82.01 6.98 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.826 0.822 . . . . 0.0 109.975 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.6 m -77.43 -168.84 1.24 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.845 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -93.42 8.49 40.33 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.692 -0.63 . . . . 0.0 111.655 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.425 ' CZ ' ' HB2' ' A' ' 5' ' ' SER . 16.7 mtm180 -96.46 -25.98 15.47 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.144 -0.972 . . . . 0.0 109.066 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 129.55 26.72 0.85 Allowed Glycine 0 N--CA 1.488 2.165 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.461 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 t70 -100.44 -170.57 1.88 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.031 -1.276 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.472 ' HA ' ' CA ' ' A' ' 4' ' ' CYS . 0.2 OUTLIER 176.25 -31.23 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.747 -0.596 . . . . 0.0 110.868 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 51.8 p90 . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.506 -0.746 . . . . 0.0 110.922 -179.836 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.698 0 CA-C-O 121.184 0.516 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.2 m -92.28 96.82 10.51 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 120.033 -0.667 . . . . 0.0 109.591 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.5 m -104.82 -162.09 0.86 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.741 -0.599 . . . . 0.0 110.887 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.6 mt -100.59 -24.9 14.34 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.342 -0.543 . . . . 0.0 111.514 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -72.62 -15.46 61.73 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.328 -0.857 . . . . 0.0 110.758 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.49 4.82 2.72 Favored Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.476 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.405 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -77.47 155.92 31.41 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 119.195 1.498 . . . . 0.0 109.555 179.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 169.35 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.376 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 16.0 p90 . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 . . . . . 0 N--CA 1.495 1.778 0 CA-C-O 120.913 0.387 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -128.98 91.46 3.21 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.459 0.647 . . . . 0.0 109.883 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.71 145.84 50.77 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.171 0.51 . . . . 0.0 110.513 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.74 65.33 2.47 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.931 0.872 . . . . 0.0 110.04 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.01 -41.26 0.09 Allowed 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 176.35 26.31 0.03 OUTLIER Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.594 -1.289 . . . . 0.0 112.064 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 18.1 p-10 -150.74 146.55 26.5 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 119.762 1.781 . . . . 0.0 110.961 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER 171.59 52.11 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.414 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 53.0 p90 . . . . . 0 C--N 1.3 -1.551 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 t80 . . . . . 0 N--CA 1.495 1.784 0 CA-C-O 121.432 0.634 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.3 m -89.51 83.56 6.35 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.62 0.724 . . . . 0.0 109.792 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 21.6 m -76.78 -173.61 2.7 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.19 0.519 . . . . 0.0 110.663 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -98.9 -12.25 20.92 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.657 -0.652 . . . . 0.0 111.473 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.5 mtm180 -72.76 -60.68 2.12 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.59 34.22 0.04 OUTLIER Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 8.7 t70 -113.17 153.43 28.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.171 -1.193 . . . . 0.0 110.089 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -173.78 29.93 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.793 -0.567 . . . . 0.0 109.651 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.8 p90 . . . . . 0 N--CA 1.491 1.603 0 O-C-N 121.621 -0.674 . . . . 0.0 109.232 -179.989 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.042 0.449 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 8.3 t -111.73 93.6 4.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.672 -0.643 . . . . 0.0 109.4 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 0.4 OUTLIER -127.64 -165.89 1.54 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.508 0.67 . . . . 0.0 112.052 -178.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.8 mt -86.36 -10.36 54.52 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 5.7 ptp180 -71.45 -17.54 62.36 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.998 -1.064 . . . . 0.0 109.891 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.48 25.0 3.02 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 15.3 p-10 -113.12 160.5 18.14 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.238 -1.154 . . . . 0.0 109.475 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 5.4 t 171.34 44.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.471 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.0 p90 . . . . . 0 C--N 1.298 -1.66 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.231 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 121.254 0.55 . . . . 0.0 110.681 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.7 m -88.11 81.36 7.42 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 121.577 0.703 . . . . 0.0 109.869 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.4 p -77.92 -166.81 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.186 0.517 . . . . 0.0 110.999 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.39 -16.96 17.44 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.649 -0.657 . . . . 0.0 111.914 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -72.54 -10.54 59.91 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.159 -0.963 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.84 21.7 3.8 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 110.207 -1.157 . . . . 0.0 110.207 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.1 t70 -99.86 157.38 16.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.238 . . . . 0.0 109.694 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.45 28.18 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.768 -0.582 . . . . 0.0 110.064 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.1 p90 . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.701 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 121.086 0.47 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.8 m -91.65 81.1 5.31 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.871 0.844 . . . . 0.0 109.646 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.405 ' HB3' ' NE ' ' A' ' 7' ' ' ARG . 58.5 m -77.29 -169.19 1.31 Allowed 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.258 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.542 HD12 ' N ' ' A' ' 6' ' ' LEU . 5.2 mp -104.08 4.11 33.94 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.704 -0.623 . . . . 0.0 111.954 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.405 ' NE ' ' HB3' ' A' ' 5' ' ' SER . 0.1 OUTLIER -95.99 -8.73 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.17 -0.956 . . . . 0.0 110.001 179.08 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 122.07 17.94 3.6 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.4 m-20 -100.58 157.87 16.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.961 -1.317 . . . . 0.0 109.589 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -173.6 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.818 -0.551 . . . . 0.0 110.18 179.827 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.3 p90 . . . . . 0 N--CA 1.49 1.535 0 O-C-N 121.556 -0.715 . . . . 0.0 109.534 179.548 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.012 0.434 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -104.11 76.72 1.37 Allowed 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.588 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.4 p -76.18 155.38 34.59 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.94 41.58 1.07 Allowed 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.143 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -152.62 14.43 0.56 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.709 -0.797 . . . . 0.0 111.571 179.014 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 139.29 16.86 0.54 Allowed Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.036 -1.554 . . . . 0.0 113.922 177.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.1 t0 -142.99 152.43 41.94 Favored 'General case' 0 N--CA 1.508 2.45 0 CA-C-N 120.873 2.336 . . . . 0.0 112.51 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -175.87 30.83 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.276 0.56 . . . . 0.0 110.259 178.821 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 34.7 p90 . . . . . 0 N--CA 1.49 1.554 0 O-C-N 121.485 -0.759 . . . . 0.0 109.526 179.084 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 . . . . . 0 N--CA 1.495 1.807 0 CA-C-O 121.298 0.57 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.6 m -90.37 80.08 6.2 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.537 0.684 . . . . 0.0 110.058 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.7 p -77.66 -169.84 1.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.906 -0.496 . . . . 0.0 110.494 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.5 mt -102.48 -13.9 17.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.686 -0.634 . . . . 0.0 111.393 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -10.14 59.48 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.244 -0.91 . . . . 0.0 110.029 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.13 33.28 1.15 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.276 -1.13 . . . . 0.0 110.276 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.445 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -117.46 157.07 26.89 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.158 -1.201 . . . . 0.0 110.064 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.79 29.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.257 0.551 . . . . 0.0 109.884 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.772 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.3 t80 . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.274 0.559 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 15.6 m -81.05 83.26 6.78 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.556 0.693 . . . . 0.0 110.03 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 m -77.4 -170.81 1.89 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.253 0.549 . . . . 0.0 110.626 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.43 -15.51 19.61 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.563 -0.71 . . . . 0.0 111.695 -179.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.54 -10.78 60.07 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.15 -0.969 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.76 36.79 0.95 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.4 OUTLIER -118.35 166.9 12.09 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.32 -1.106 . . . . 0.0 110.4 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.59 26.13 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 CA-C-O 121.168 0.508 . . . . 0.0 110.117 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 49.2 p90 . . . . . 0 N--CA 1.488 1.425 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 179.728 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.237 0.542 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 38.2 t -107.13 90.15 3.21 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 m -75.79 -170.06 1.23 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mt -112.58 34.5 4.32 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.496 -0.752 . . . . 0.0 110.883 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.32 16.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 119.559 -0.857 . . . . 0.0 112.155 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.24 -1.48 1.44 Allowed Glycine 0 N--CA 1.499 2.872 0 C-N-CA 119.013 -1.565 . . . . 0.0 112.872 178.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.2 m-20 -113.35 147.77 37.03 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 119.857 1.828 . . . . 0.0 111.136 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.19 41.1 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.326 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 p90 . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.83 -0.544 . . . . 0.0 109.631 -179.669 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.8 t80 . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 121.385 0.612 . . . . 0.0 111.503 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.2 m -101.32 81.83 2.25 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.621 0.724 . . . . 0.0 109.871 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 t -77.47 -169.62 1.5 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.929 -0.482 . . . . 0.0 110.897 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.5 mt -104.23 -3.63 24.07 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.663 -0.648 . . . . 0.0 111.886 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.41 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -90.46 -7.87 51.96 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.198 -0.939 . . . . 0.0 110.247 179.277 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.71 3.79 5.41 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 9.5 m-20 -83.22 149.57 26.74 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 118.959 1.379 . . . . 0.0 109.875 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER 179.93 35.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.652 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.6 p90 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.659 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 121.318 0.58 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -108.61 80.58 1.36 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.434 0.635 . . . . 0.0 109.925 179.486 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.415 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 4.3 m -80.26 -168.19 1.59 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.736 -0.602 . . . . 0.0 110.556 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.5 mt -103.83 -14.59 15.98 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.676 -0.64 . . . . 0.0 111.258 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.415 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.4 mtm180 -72.9 -63.11 1.24 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.25 -0.906 . . . . 0.0 108.767 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.31 29.94 0.08 OUTLIER Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.894 -1.282 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.24 147.03 30.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.165 -1.197 . . . . 0.0 110.08 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.81 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.531 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -179.7 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.063 0.458 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 6.1 m -89.43 81.59 6.57 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.822 0.82 . . . . 0.0 109.866 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -77.63 -165.91 0.69 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.83 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mt -100.35 -18.3 16.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.659 -0.65 . . . . 0.0 111.776 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -72.82 -13.33 61.27 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.204 -0.935 . . . . 0.0 110.571 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.78 21.52 3.21 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 110.378 -1.089 . . . . 0.0 110.378 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 5.4 t70 -99.12 163.75 12.44 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.13 -1.218 . . . . 0.0 109.364 179.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.87 27.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.764 -0.585 . . . . 0.0 110.261 179.797 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 40.0 p90 . . . . . 0 N--CA 1.488 1.438 0 O-C-N 121.456 -0.777 . . . . 0.0 109.553 179.549 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.681 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 96.6 m -92.33 100.16 12.79 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.612 -0.68 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -145.4 143.16 29.93 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.557 -0.714 . . . . 0.0 111.375 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -117.92 78.86 1.29 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.728 -0.608 . . . . 0.0 109.927 179.31 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.402 ' HB3' ' NE ' ' A' ' 7' ' ' ARG . 5.6 m -79.08 -172.31 3.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.744 -0.598 . . . . 0.0 110.447 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.6 mt -107.15 19.04 20.94 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.547 -0.72 . . . . 0.0 111.049 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.427 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -116.23 -64.92 1.24 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.275 -0.89 . . . . 0.0 109.255 179.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -156.63 18.77 0.43 Allowed Glycine 0 N--CA 1.49 2.261 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.886 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -109.0 138.19 45.73 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-N 118.782 1.291 . . . . 0.0 110.11 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 172.22 47.71 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.776 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.5 p90 -169.43 -171.74 1.32 Allowed 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 67.0 m -125.18 175.21 7.55 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.04 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.358 0 O-C-N 119.852 -1.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.679 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 74.5 m -127.66 47.82 2.33 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.556 -0.715 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -146.26 177.93 8.63 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.809 -0.557 . . . . 0.0 109.877 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.472 ' CA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -88.59 82.01 6.98 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.826 0.822 . . . . 0.0 109.975 179.863 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.6 m -77.43 -168.84 1.24 Allowed 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.845 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -93.42 8.49 40.33 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.692 -0.63 . . . . 0.0 111.655 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.425 ' CZ ' ' HB2' ' A' ' 5' ' ' SER . 16.7 mtm180 -96.46 -25.98 15.47 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.144 -0.972 . . . . 0.0 109.066 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 129.55 26.72 0.85 Allowed Glycine 0 N--CA 1.488 2.165 0 N-CA-C 110.499 -1.04 . . . . 0.0 110.499 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.461 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.7 t70 -100.44 -170.57 1.88 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.031 -1.276 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.472 ' HA ' ' CA ' ' A' ' 4' ' ' CYS . 0.2 OUTLIER 176.25 -31.23 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.747 -0.596 . . . . 0.0 110.868 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 51.8 p90 -126.83 175.64 7.88 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.506 -0.746 . . . . 0.0 110.922 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.7 t -92.03 71.67 5.51 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.711 -0.618 . . . . 0.0 110.07 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.37 0 O-C-N 119.871 -1.768 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.629 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.89 155.43 23.67 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.637 -0.665 . . . . 0.0 109.964 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -120.79 48.72 1.57 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.465 -0.772 . . . . 0.0 110.274 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.2 m -92.28 96.82 10.51 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 120.033 -0.667 . . . . 0.0 109.591 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.5 m -104.82 -162.09 0.86 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.741 -0.599 . . . . 0.0 110.887 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.6 mt -100.59 -24.9 14.34 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 120.342 -0.543 . . . . 0.0 111.514 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -72.62 -15.46 61.73 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.328 -0.857 . . . . 0.0 110.758 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.49 4.82 2.72 Favored Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.476 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.405 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.9 OUTLIER -77.47 155.92 31.41 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 119.195 1.498 . . . . 0.0 109.555 179.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 169.35 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.376 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 16.0 p90 -112.97 74.64 0.87 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 75.6 m -50.38 151.73 2.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.836 -0.54 . . . . 0.0 111.259 -177.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.358 0 O-C-N 119.883 -1.76 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.633 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m -89.65 149.7 22.68 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.557 -0.714 . . . . 0.0 109.559 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -145.44 118.45 8.8 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.405 -0.809 . . . . 0.0 111.638 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -128.98 91.46 3.21 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.459 0.647 . . . . 0.0 109.883 178.743 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.71 145.84 50.77 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.171 0.51 . . . . 0.0 110.513 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.74 65.33 2.47 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.931 0.872 . . . . 0.0 110.04 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.01 -41.26 0.09 Allowed 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 176.35 26.31 0.03 OUTLIER Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.594 -1.289 . . . . 0.0 112.064 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.407 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 18.1 p-10 -150.74 146.55 26.5 Favored 'General case' 0 N--CA 1.499 1.976 0 CA-C-N 119.762 1.781 . . . . 0.0 110.961 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.1 OUTLIER 171.59 52.11 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.414 ' CD2' ' O ' ' A' ' 11' ' ' TYR . 53.0 p90 -168.79 126.68 1.03 Allowed 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.0 t -87.49 -46.97 9.12 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.644 -0.822 . . . . 0.0 110.346 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.344 0 O-C-N 119.887 -1.758 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.698 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 22.3 m -90.08 51.01 1.96 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.606 -0.684 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -146.6 163.1 36.91 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.564 -0.71 . . . . 0.0 111.302 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.3 m -89.51 83.56 6.35 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-O 121.62 0.724 . . . . 0.0 109.792 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 21.6 m -76.78 -173.61 2.7 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.19 0.519 . . . . 0.0 110.663 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mt -98.9 -12.25 20.92 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.657 -0.652 . . . . 0.0 111.473 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.5 mtm180 -72.76 -60.68 2.12 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 174.59 34.22 0.04 OUTLIER Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 8.7 t70 -113.17 153.43 28.3 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.171 -1.193 . . . . 0.0 110.089 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -173.78 29.93 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.793 -0.567 . . . . 0.0 109.651 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -171.14 -167.31 0.53 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.621 -0.674 . . . . 0.0 109.232 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.3 m -107.57 -59.72 1.79 Allowed 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.162 179.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.343 0 O-C-N 119.92 -1.737 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.628 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 62.6 m -77.81 -166.93 0.86 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.572 -0.705 . . . . 0.0 109.918 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -121.91 101.26 7.45 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.608 -0.683 . . . . 0.0 111.348 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 8.3 t -111.73 93.6 4.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.672 -0.643 . . . . 0.0 109.4 178.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.416 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 0.4 OUTLIER -127.64 -165.89 1.54 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.508 0.67 . . . . 0.0 112.052 -178.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.8 mt -86.36 -10.36 54.52 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 5.7 ptp180 -71.45 -17.54 62.36 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.998 -1.064 . . . . 0.0 109.891 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.48 25.0 3.02 Favored Glycine 0 N--CA 1.486 2.021 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.514 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 15.3 p-10 -113.12 160.5 18.14 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.238 -1.154 . . . . 0.0 109.475 179.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 5.4 t 171.34 44.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.471 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -165.71 142.45 5.41 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.4 m -67.19 114.08 5.64 Favored 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.118 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.36 0 O-C-N 119.782 -1.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.683 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.65 49.38 1.54 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.561 -0.712 . . . . 0.0 110.079 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -146.6 167.8 22.85 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.727 -0.608 . . . . 0.0 110.681 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.7 m -88.11 81.36 7.42 Favored 'General case' 0 N--CA 1.49 1.548 0 CA-C-O 121.577 0.703 . . . . 0.0 109.869 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.4 p -77.92 -166.81 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.186 0.517 . . . . 0.0 110.999 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mt -100.39 -16.96 17.44 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.649 -0.657 . . . . 0.0 111.914 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -72.54 -10.54 59.91 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.159 -0.963 . . . . 0.0 110.402 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.84 21.7 3.8 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 110.207 -1.157 . . . . 0.0 110.207 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.1 t70 -99.86 157.38 16.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.095 -1.238 . . . . 0.0 109.694 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.45 28.18 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.768 -0.582 . . . . 0.0 110.064 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -170.51 -167.67 0.62 Allowed 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -104.36 115.13 29.84 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.851 -0.74 . . . . 0.0 109.818 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.334 0 O-C-N 119.821 -1.799 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.625 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 73.2 m -101.29 44.96 0.99 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.564 -0.71 . . . . 0.0 109.87 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -147.3 179.01 7.95 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.893 -0.504 . . . . 0.0 110.211 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.8 m -91.65 81.1 5.31 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.871 0.844 . . . . 0.0 109.646 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.405 ' HB3' ' NE ' ' A' ' 7' ' ' ARG . 58.5 m -77.29 -169.19 1.31 Allowed 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.258 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.542 HD12 ' N ' ' A' ' 6' ' ' LEU . 5.2 mp -104.08 4.11 33.94 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.704 -0.623 . . . . 0.0 111.954 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.405 ' NE ' ' HB3' ' A' ' 5' ' ' SER . 0.1 OUTLIER -95.99 -8.73 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.17 -0.956 . . . . 0.0 110.001 179.08 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 122.07 17.94 3.6 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.454 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.4 m-20 -100.58 157.87 16.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.961 -1.317 . . . . 0.0 109.589 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -173.6 28.2 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.818 -0.551 . . . . 0.0 110.18 179.827 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -169.85 169.22 8.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.556 -0.715 . . . . 0.0 109.534 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 t -103.44 118.88 37.76 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.246 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.333 0 O-C-N 119.796 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.65 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 77.7 m -92.41 50.88 1.67 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.549 -0.719 . . . . 0.0 109.806 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -146.97 -179.72 7.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.817 -0.552 . . . . 0.0 110.165 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -104.11 76.72 1.37 Allowed 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.588 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.4 p -76.18 155.38 34.59 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 178.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 76.8 mt -91.94 41.58 1.07 Allowed 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.713 -0.795 . . . . 0.0 111.143 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -152.62 14.43 0.56 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.709 -0.797 . . . . 0.0 111.571 179.014 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 139.29 16.86 0.54 Allowed Glycine 0 N--CA 1.498 2.803 0 C-N-CA 119.036 -1.554 . . . . 0.0 113.922 177.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 7' ' ' ARG . 1.1 t0 -142.99 152.43 41.94 Favored 'General case' 0 N--CA 1.508 2.45 0 CA-C-N 120.873 2.336 . . . . 0.0 112.51 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.514 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.6 OUTLIER -175.87 30.83 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.276 0.56 . . . . 0.0 110.259 178.821 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -170.4 167.56 8.24 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.485 -0.759 . . . . 0.0 109.526 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 15.5 t -108.09 104.77 14.27 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.563 -0.711 . . . . 0.0 110.181 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.337 0 O-C-N 119.824 -1.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.648 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.83 54.67 1.15 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.622 -0.674 . . . . 0.0 110.077 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -145.93 168.91 19.69 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.522 -0.736 . . . . 0.0 110.858 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.6 m -90.37 80.08 6.2 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.537 0.684 . . . . 0.0 110.058 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.7 p -77.66 -169.84 1.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.906 -0.496 . . . . 0.0 110.494 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.5 mt -102.48 -13.9 17.05 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.686 -0.634 . . . . 0.0 111.393 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -10.14 59.48 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.244 -0.91 . . . . 0.0 110.029 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.13 33.28 1.15 Allowed Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.276 -1.13 . . . . 0.0 110.276 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.445 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER -117.46 157.07 26.89 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.158 -1.201 . . . . 0.0 110.064 179.609 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -172.79 29.03 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.257 0.551 . . . . 0.0 109.884 179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -170.9 -166.74 0.5 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.63 95.39 6.19 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.915 -0.714 . . . . 0.0 109.952 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.34 0 O-C-N 119.871 -1.768 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.218 -0.582 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.6 54.31 0.75 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.479 -0.763 . . . . 0.0 109.748 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -145.94 170.21 17.07 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.612 -0.68 . . . . 0.0 110.607 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 15.6 m -81.05 83.26 6.78 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-O 121.556 0.693 . . . . 0.0 110.03 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 m -77.4 -170.81 1.89 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.253 0.549 . . . . 0.0 110.626 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -98.43 -15.51 19.61 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.563 -0.71 . . . . 0.0 111.695 -179.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.54 -10.78 60.07 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.15 -0.969 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.76 36.79 0.95 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.446 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.4 OUTLIER -118.35 166.9 12.09 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.32 -1.106 . . . . 0.0 110.4 179.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -174.59 26.13 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.378 0 CA-C-O 121.168 0.508 . . . . 0.0 110.117 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -170.42 -165.01 0.43 Allowed 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -95.37 -73.73 0.58 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.837 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.372 0 O-C-N 119.861 -1.774 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.218 -0.58 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.5 m -93.83 111.21 22.87 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.516 -0.74 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -145.3 131.37 19.33 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.543 -0.723 . . . . 0.0 110.999 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 10' ' ' CYS . 38.2 t -107.13 90.15 3.21 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.553 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 m -75.79 -170.06 1.23 Allowed 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 mt -112.58 34.5 4.32 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.496 -0.752 . . . . 0.0 110.883 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.32 16.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 119.559 -0.857 . . . . 0.0 112.155 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.24 -1.48 1.44 Allowed Glycine 0 N--CA 1.499 2.872 0 C-N-CA 119.013 -1.565 . . . . 0.0 112.872 178.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 1.2 m-20 -113.35 147.77 37.03 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 119.857 1.828 . . . . 0.0 111.136 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.19 41.1 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.326 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -171.03 -165.91 0.44 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.83 -0.544 . . . . 0.0 109.631 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -112.32 107.73 16.67 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 120.114 -0.635 . . . . 0.0 109.87 179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.374 0 O-C-N 119.805 -1.81 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.216 -0.666 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.6 m -83.02 96.88 8.48 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.602 -0.686 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -145.33 146.52 31.65 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.485 -0.76 . . . . 0.0 111.503 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 1.2 m -101.32 81.83 2.25 Favored 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.621 0.724 . . . . 0.0 109.871 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 t -77.47 -169.62 1.5 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.929 -0.482 . . . . 0.0 110.897 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.5 mt -104.23 -3.63 24.07 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.663 -0.648 . . . . 0.0 111.886 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.41 ' HD3' ' N ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -90.46 -7.87 51.96 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.198 -0.939 . . . . 0.0 110.247 179.277 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.71 3.79 5.41 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 9.5 m-20 -83.22 149.57 26.74 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 118.959 1.379 . . . . 0.0 109.875 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.7 OUTLIER 179.93 35.79 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.455 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 179.652 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.6 p90 -171.41 -170.9 0.87 Allowed 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.5 m -100.03 99.64 10.41 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 119.752 -0.779 . . . . 0.0 110.181 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.352 0 O-C-N 119.837 -1.789 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.623 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 m -91.53 123.53 35.02 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.58 -0.7 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -145.18 140.51 27.99 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.477 -0.764 . . . . 0.0 111.149 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -108.61 80.58 1.36 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 121.434 0.635 . . . . 0.0 109.925 179.486 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.415 ' CB ' ' CZ ' ' A' ' 7' ' ' ARG . 4.3 m -80.26 -168.19 1.59 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.736 -0.602 . . . . 0.0 110.556 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.5 mt -103.83 -14.59 15.98 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.676 -0.64 . . . . 0.0 111.258 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.415 ' CZ ' ' CB ' ' A' ' 5' ' ' SER . 16.4 mtm180 -72.9 -63.11 1.24 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.25 -0.906 . . . . 0.0 108.767 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -175.31 29.94 0.08 OUTLIER Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.894 -1.282 . . . . 0.0 109.894 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.431 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -107.24 147.03 30.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.165 -1.197 . . . . 0.0 110.08 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.5 OUTLIER 175.81 38.17 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.531 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -171.11 -173.61 1.32 Allowed 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.0 m -103.04 139.98 37.88 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.728 -0.789 . . . . 0.0 110.1 179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.376 0 O-C-N 119.931 -1.73 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.217 -0.632 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 94.6 m -110.71 45.52 1.14 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.479 -0.763 . . . . 0.0 110.057 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -147.16 -172.96 4.12 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.87 -0.519 . . . . 0.0 110.302 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 9' ' ' ASP . 6.1 m -89.43 81.59 6.57 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-O 121.822 0.82 . . . . 0.0 109.866 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 70.7 m -77.63 -165.91 0.69 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.83 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.2 mt -100.35 -18.3 16.84 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.659 -0.65 . . . . 0.0 111.776 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -72.82 -13.33 61.27 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.204 -0.935 . . . . 0.0 110.571 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.78 21.52 3.21 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 110.378 -1.089 . . . . 0.0 110.378 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.464 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 5.4 t70 -99.12 163.75 12.44 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.13 -1.218 . . . . 0.0 109.364 179.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 0.8 OUTLIER -172.87 27.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.764 -0.585 . . . . 0.0 110.261 179.797 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -169.98 174.66 5.44 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.456 -0.777 . . . . 0.0 109.553 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.4 t -105.8 -37.18 6.79 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.281 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.377 0 O-C-N 119.932 -1.73 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_