data_6u4n_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6u4n _Structure_validation_residue.Date_analyzed 2019-10-18 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 ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.676 ' HG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -96.16 125.66 40.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.273 -1.134 . . . . 0.0 109.999 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.468 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -128.97 120.97 27.03 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 178.18 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.86 127.74 33.91 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.963 -1.086 . . . . 0.0 109.02 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.477 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.95 134.59 34.65 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -77.98 145.4 36.04 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.487 -0.885 . . . . 0.0 108.981 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.84 104.06 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-O 121.829 0.823 . . . . 0.0 109.909 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -79.66 104.5 10.3 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.507 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.6 t -74.76 118.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.047 -1.461 . . . . 0.0 109.114 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.3 p -85.32 -25.96 26.85 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.411 -0.806 . . . . 0.0 109.39 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -78.04 -8.16 57.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 108.702 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mt -130.3 -22.64 2.77 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 75.47 12.56 3.16 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.331 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.427 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 74.9 mtp180 -95.32 -178.62 4.5 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.161 -0.962 . . . . 0.0 109.661 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 29' ' ' ARG . 72.4 m-20 -136.16 113.93 11.12 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 t -113.87 157.54 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-O 121.342 0.592 . . . . 0.0 109.489 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.51 135.99 50.18 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -115.34 113.55 23.95 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.777 -0.577 . . . . 0.0 109.743 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.676 ' NE ' ' HG1' ' A' ' 17' ' ' THR . 9.0 tpt180 -60.25 105.6 0.43 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.9 m -134.18 -169.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.908 0.861 . . . . 0.0 110.591 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p -140.44 172.42 12.75 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.468 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -79.94 46.48 3.15 Favored Glycine 0 N--CA 1.485 1.903 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -149.75 4.31 0.57 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.675 -0.897 . . . . 0.0 108.928 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 m -87.02 137.29 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.945 -1.097 . . . . 0.0 109.959 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.488 ' O ' ' N ' ' A' ' 43' ' ' GLY . 4.2 m80 -79.73 147.83 31.76 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.042 -1.037 . . . . 0.0 108.656 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.463 ' C ' ' H ' ' A' ' 43' ' ' GLY . 59.5 mt -48.46 -52.56 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.126 -0.984 . . . . 0.0 109.381 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.64 -15.24 4.28 Favored Glycine 0 N--CA 1.484 1.857 0 N-CA-C 108.107 -1.997 . . . . 0.0 108.107 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -81.43 -28.32 44.4 Favored Glycine 0 N--CA 1.481 1.698 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.401 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.16 -55.29 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -1.126 . . . . 0.0 109.487 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -37.2 30.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.715 -1.24 . . . . 0.0 108.859 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.5 tp -57.52 -65.57 0.61 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.204 -0.935 . . . . 0.0 109.412 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -51.42 -59.46 4.21 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.409 -0.807 . . . . 0.0 111.523 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.1 tp -45.78 -46.07 15.08 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.091 -1.006 . . . . 0.0 109.83 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.49 ' O ' ' N ' ' A' ' 52' ' ' LEU . 11.6 t -67.21 -48.38 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.032 -1.043 . . . . 0.0 108.826 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -45.04 -40.42 6.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.354 -0.841 . . . . 0.0 109.683 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -66.74 -31.9 72.86 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.349 -0.844 . . . . 0.0 108.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 49' ' ' VAL . 3.7 tp -67.7 -66.55 0.55 Allowed 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 t70 64.42 75.89 0.36 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.747 0.784 . . . . 0.0 110.051 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.577 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.5 p -173.07 152.55 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 C-N-CA 120.186 -0.605 . . . . 0.0 109.799 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -71.01 37.52 0.05 Allowed 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.577 ' H ' ' C ' ' A' ' 54' ' ' VAL . 19.2 tttp -77.97 179.97 6.44 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.082 -1.011 . . . . 0.0 109.237 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.521 ' N ' ' OD2' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -60.13 92.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.312 -0.867 . . . . 0.0 110.223 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 16.4 m0 -91.07 -35.98 14.29 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.253 -0.904 . . . . 0.0 109.511 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.593 ' C ' ' H ' ' A' ' 61' ' ' HIS . 3.7 t -73.99 -34.37 64.18 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.967 -1.083 . . . . 0.0 108.838 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -71.88 19.27 0.07 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.639 ' CD2' ' CE1' ' A' ' 92' ' ' PHE . 5.7 t-80 -105.65 130.43 53.68 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 122.024 0.916 . . . . 0.0 111.864 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.563 ' N ' ' HD1' ' A' ' 61' ' ' HIS . . . -170.02 145.19 2.84 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.546 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.1 mm? -94.93 143.03 26.8 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.771 -1.206 . . . . 0.0 110.363 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.522 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.73 150.03 49.97 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.31 93.61 4.6 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.029 -1.044 . . . . 0.0 108.725 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -55.21 -23.73 23.73 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 111.058 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.507 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.2 mmtp -69.23 -8.89 49.99 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 178.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.6 mmtt -133.32 -12.43 2.77 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.731 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.39 46.21 27.09 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -178.148 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.465 ' HG1' ' H ' ' A' ' 71' ' ' TRP . 5.6 t -112.43 -172.93 2.14 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.362 0.601 . . . . 0.0 109.868 -178.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.557 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.04 98.66 5.2 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 177.424 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.0 mt -60.34 91.01 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 122.618 1.199 . . . . 0.0 109.984 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 71' ' ' TRP . 1.9 pp -123.64 14.55 9.44 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.605 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.44 72.36 6.98 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.275 -0.891 . . . . 0.0 109.332 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 m -62.38 -13.67 31.9 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.978 -1.076 . . . . 0.0 110.002 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.69 -50.91 15.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.102 -0.999 . . . . 0.0 109.767 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -172.14 1.65 Allowed 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.661 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -137.73 -164.92 1.69 Allowed 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.626 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.533 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.0 mp -69.72 -59.63 2.83 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -46.91 -51.99 15.53 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.137 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.661 ' CG ' ' H ' ' A' ' 78' ' ' THR . 33.8 mmtt -44.91 -55.01 5.84 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.542 0.687 . . . . 0.0 109.966 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.23 -40.22 59.25 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.136 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.88 7.01 8.91 Favored Glycine 0 N--CA 1.5 2.95 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.528 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 52.8 mt -62.0 160.86 2.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.45 -1.029 . . . . 0.0 109.386 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.92 -163.47 0.26 Allowed 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.1 62.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.88 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -75.12 -9.93 59.0 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.68 113.64 26.22 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -94.46 116.53 28.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.985 -1.072 . . . . 0.0 109.524 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.1 mt -94.81 176.79 6.13 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.444 0.64 . . . . 0.0 109.296 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.522 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.8 mt-30 -132.35 159.25 39.74 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.639 ' CE1' ' CD2' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -115.89 94.2 4.58 Favored 'General case' 0 N--CA 1.503 2.183 0 CA-C-O 122.484 1.135 . . . . 0.0 108.023 179.237 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.439 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.542 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.488 1.462 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.25 135.75 57.82 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 120.855 -1.153 . . . . 0.0 110.315 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.81 103.9 13.46 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.5 t -51.21 127.05 18.34 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 122.191 0.996 . . . . 0.0 109.59 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.67 -34.59 5.39 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 106.161 -2.776 . . . . 0.0 106.161 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.85 -35.57 7.29 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.5 mm-40 55.02 56.37 6.67 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.699 1.237 . . . . 0.0 109.957 -178.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -140.64 123.78 10.06 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -44.21 135.38 8.54 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 CA-C-N 120.489 1.21 . . . . 0.0 114.604 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.1 mt -93.4 98.34 8.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.424 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.3 p -99.38 91.57 5.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.246 -0.909 . . . . 0.0 111.223 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.6 -95.26 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.481 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -114.76 152.33 32.26 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 177.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.6 126.53 15.4 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.932 -1.105 . . . . 0.0 111.541 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.9 mt -91.01 146.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 7.9 m -118.48 146.94 44.11 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-O 121.79 0.805 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.738 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.53 -129.39 0.26 Allowed 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.604 0.716 . . . . 0.0 109.331 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.554 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.3 mtt -65.78 26.34 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.738 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.01 -8.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.73 161.0 23.5 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.73 174.29 5.94 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -160.2 136.34 8.64 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.233 -1.387 . . . . 0.0 109.861 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.572 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.61 114.99 8.3 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.581 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.1 Cg_exo -45.69 -12.44 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 CA-C-N 120.316 1.148 . . . . 0.0 111.449 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.572 ' N ' ' O ' ' B' ' 569' ' ' HIS . 11.9 mt-10 -96.51 -52.73 3.84 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 122.001 0.905 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.517 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 19.1 m170 -57.61 -4.29 0.25 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.897 -1.127 . . . . 0.0 109.886 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.496 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.7 t80 -127.34 55.04 1.62 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 17.1 m -94.48 177.73 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.802 0.81 . . . . 0.0 111.116 -178.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.441 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.19 143.42 29.63 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.408 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . 0.453 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -92.98 75.56 4.76 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 116.769 -1.972 . . . . 0.0 109.589 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -153.29 -54.51 0.11 Allowed 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 102.599 -3.112 . . . . 0.0 102.599 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.529 ' O ' ' N ' ' B' ' 580' ' ' LYS . 23.8 p -127.57 78.89 1.85 Allowed 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 111.567 -2.561 . . . . 0.0 104.253 177.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.5 mt -53.14 15.55 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.84 -37.13 18.03 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 119.735 -1.853 . . . . 0.0 112.122 -178.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.581 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.8 tp60 -159.65 140.89 12.69 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 119.636 -1.915 . . . . 0.0 114.466 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.441 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 23.0 tp -136.34 170.68 15.64 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.434 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.2 m-20 -144.94 128.47 17.03 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.277 -0.89 . . . . 0.0 109.143 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -15.99 0.8 Allowed 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.43 -0.794 . . . . 0.0 109.625 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.17 -21.05 50.98 Favored Glycine 0 N--CA 1.485 1.91 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -133.73 28.91 3.89 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.576 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.7 OUTLIER -89.94 108.98 20.04 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.489 1.137 . . . . 0.0 110.115 -179.692 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.5 160.0 14.81 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.8 tt0 -154.82 157.0 37.24 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 122.584 1.183 . . . . 0.0 111.115 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.452 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 2.9 pt20 -156.65 146.04 20.57 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 177.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.668 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.88 23.8 0.74 Allowed 'General case' 0 C--N 1.289 -2.048 0 O-C-N 121.29 -0.881 . . . . 0.0 109.465 -178.656 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.6 m-20 82.93 -7.06 1.23 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.791 -0.568 . . . . 0.0 111.661 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.7 mttm -86.01 116.22 64.87 Favored Pre-proline 0 C--N 1.293 -1.867 0 O-C-N 121.042 -1.036 . . . . 0.0 110.723 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.471 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.4 Cg_exo -52.57 162.84 2.09 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 CA-C-N 119.919 1.007 . . . . 0.0 112.328 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.471 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 20.1 m-85 -171.27 143.63 1.9 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.247 -0.908 . . . . 0.0 110.289 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.4 m -75.29 153.87 37.7 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 173.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.462 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -56.97 -57.13 13.87 Favored 'General case' 0 C--N 1.289 -2.036 0 C-N-CA 117.475 -1.69 . . . . 0.0 106.813 179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.27 -28.77 1.38 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.48 -0.763 . . . . 0.0 109.6 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 80.1 m -82.76 -61.08 1.97 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.312 -0.867 . . . . 0.0 109.039 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.45 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 1.1 t80 -55.45 -55.33 32.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.535 -0.728 . . . . 0.0 109.582 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.464 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.21 -42.83 31.16 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.209 -0.932 . . . . 0.0 109.14 -178.939 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -56.34 -23.85 40.01 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.215 -0.928 . . . . 0.0 110.002 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 4.6 mt -89.16 -56.9 3.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.921 -1.112 . . . . 0.0 111.303 -178.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.496 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 16.7 m-85 -109.99 -25.72 10.11 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.262 -0.899 . . . . 0.0 110.59 -178.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.496 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.0 p . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.056 -1.028 . . . . 0.0 109.949 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.459 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 108.51 -1.836 . . . . 0.0 108.51 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.7 t -90.18 123.23 33.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.57 -0.959 . . . . 0.0 109.907 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.459 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -134.61 123.33 23.63 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.94 130.12 37.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.135 -0.978 . . . . 0.0 109.136 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.456 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -84.09 134.27 34.61 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.74 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -78.14 145.74 35.5 Favored 'General case' 0 C--N 1.297 -1.694 0 O-C-N 121.296 -0.877 . . . . 0.0 109.77 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 36.7 t -136.73 105.37 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.926 0.87 . . . . 0.0 109.767 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -78.72 104.86 9.62 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.549 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -71.95 100.61 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 O-C-N 121.336 -0.852 . . . . 0.0 110.077 -178.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.586 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -76.07 177.0 7.44 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 178.83 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.9 t70 56.8 6.57 0.31 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.727 -1.233 . . . . 0.0 107.918 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.586 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.8 mt -149.27 -37.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 77.25 15.97 1.72 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.521 178.402 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -91.17 -178.97 5.31 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.613 -1.304 . . . . 0.0 108.635 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -140.74 116.93 10.6 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.1 t -119.02 157.43 20.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-O 121.56 0.695 . . . . 0.0 109.792 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.43 134.6 43.81 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -114.3 114.13 25.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.6 -0.687 . . . . 0.0 109.398 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.436 ' HE ' ' HB3' ' A' ' 19' ' ' GLU . 1.3 tpp85 -57.84 108.52 0.59 Allowed 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.7 m -137.45 -169.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 122.062 0.934 . . . . 0.0 110.352 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.42 ' H ' HG11 ' A' ' 39' ' ' VAL . 11.3 p -141.81 174.42 10.59 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.442 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -81.48 47.29 3.59 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -150.77 4.33 0.49 Allowed 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.737 -0.861 . . . . 0.0 108.994 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.42 HG11 ' H ' ' A' ' 36' ' ' THR . 2.5 m -86.01 143.35 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 120.914 -1.116 . . . . 0.0 109.846 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.503 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -78.56 146.36 34.3 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 179.446 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.52 ' C ' ' H ' ' A' ' 43' ' ' GLY . 97.3 mt -49.57 -56.33 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.053 -1.029 . . . . 0.0 108.828 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.45 -9.56 3.47 Favored Glycine 0 N--CA 1.485 1.912 0 N-CA-C 108.089 -2.004 . . . . 0.0 108.089 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.52 ' H ' ' C ' ' A' ' 41' ' ' ILE . . . -73.73 -28.0 66.01 Favored Glycine 0 N--CA 1.484 1.878 0 N-CA-C 107.611 -2.196 . . . . 0.0 107.611 178.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.38 -41.41 16.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 41.5 mtm -48.43 -36.67 15.35 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -71.57 -66.03 0.68 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.391 0.615 . . . . 0.0 110.096 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.401 ' O ' ' C ' ' A' ' 48' ' ' LEU . 47.0 mttm -53.37 -55.78 22.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.306 -0.871 . . . . 0.0 110.666 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -45.83 -58.45 3.5 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.924 -1.11 . . . . 0.0 109.004 -179.254 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.513 ' O ' ' N ' ' A' ' 52' ' ' LEU . 73.2 t -57.29 -48.26 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.752 -0.592 . . . . 0.0 110.25 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -44.7 -40.04 5.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.081 -1.012 . . . . 0.0 109.512 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.508 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -70.7 -26.37 63.38 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.457 -0.777 . . . . 0.0 109.446 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.6 tp -80.04 -75.05 0.27 Allowed 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.338 -0.851 . . . . 0.0 108.801 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 t70 71.4 83.13 0.14 Allowed 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.835 0.826 . . . . 0.0 110.6 178.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.603 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -170.26 151.84 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.0 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.354 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.46 30.71 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 109.379 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.603 ' H ' ' C ' ' A' ' 54' ' ' VAL . 49.7 tttm -77.73 171.58 14.73 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.011 -1.055 . . . . 0.0 108.413 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.497 ' N ' ' OD1' ' A' ' 57' ' ' ASP . 0.6 OUTLIER -92.67 90.7 7.2 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 120.974 -1.079 . . . . 0.0 109.509 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.448 ' O ' ' O ' ' A' ' 61' ' ' HIS . 2.3 m0 -76.59 -51.56 11.4 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.177 -0.952 . . . . 0.0 108.529 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.52 ' HG ' ' H ' ' A' ' 60' ' ' ASP . 71.8 p -41.51 -56.14 2.63 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.312 0.577 . . . . 0.0 110.406 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.52 ' H ' ' HG ' ' A' ' 59' ' ' SER . 10.5 t0 -52.25 -40.5 61.78 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' O ' ' A' ' 58' ' ' TRP . 16.0 m170 -85.0 123.13 30.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.81 0.814 . . . . 0.0 110.324 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.16 -179.98 5.66 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.573 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.29 143.03 26.74 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.868 -1.145 . . . . 0.0 109.857 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.536 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -130.34 151.7 50.56 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.264 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -110.62 94.55 5.06 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.104 -0.998 . . . . 0.0 108.641 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.418 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 8.5 pt-20 -56.12 -23.55 35.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.245 -0.91 . . . . 0.0 110.813 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.512 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.7 mmtp -68.43 -9.64 49.94 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.1 mmtt -133.1 -12.17 2.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.915 -178.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.67 46.15 27.27 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -178.151 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -113.61 -173.5 2.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.612 0.72 . . . . 0.0 110.126 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.57 102.44 7.37 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 35.6 mt -61.9 86.57 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.325 0 O-C-N 120.504 -1.373 . . . . 0.0 110.548 -176.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.2 pp -120.99 10.88 10.89 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -87.07 36.33 0.73 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 21.6 m -46.01 -14.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.223 -0.923 . . . . 0.0 110.058 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.604 ' HD1' ' H ' ' A' ' 76' ' ' HIS . 8.4 m80 -62.63 -29.03 70.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.136 -0.977 . . . . 0.0 109.249 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 77.1 m95 -104.17 -155.26 0.53 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.438 -0.789 . . . . 0.0 109.406 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.612 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -144.44 171.29 14.56 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.165 0.983 . . . . 0.0 109.386 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.472 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 7.7 mp -48.11 -62.34 1.52 Allowed 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.127 0.965 . . . . 0.0 108.515 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -45.94 -52.01 12.33 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.874 0.845 . . . . 0.0 110.085 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.612 ' CG ' ' H ' ' A' ' 78' ' ' THR . 31.7 mmtt -45.13 -55.58 5.57 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 121.552 0.691 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.09 -41.86 63.61 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.979 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 121.65 7.08 8.3 Favored Glycine 0 N--CA 1.499 2.89 0 N-CA-C 108.844 -1.703 . . . . 0.0 108.844 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.532 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 50.5 mt -62.33 161.04 2.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.486 -1.008 . . . . 0.0 109.282 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.532 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.18 -164.63 0.36 Allowed 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.0 -24.29 62.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.403 -0.811 . . . . 0.0 109.694 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 88' ' ' ALA . 28.1 p30 -76.26 -11.46 59.92 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.267 -0.896 . . . . 0.0 108.67 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.456 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.55 113.52 25.97 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -94.46 117.14 29.67 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.106 -0.996 . . . . 0.0 109.773 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.5 mt -93.84 176.52 6.32 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.466 0.65 . . . . 0.0 109.25 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.536 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.6 mt-30 -133.34 167.73 19.88 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.441 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 25.0 t80 -124.01 99.0 6.04 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.154 0 O-C-N 121.356 -0.84 . . . . 0.0 111.037 -176.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.06 135.17 57.63 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 120.811 -1.181 . . . . 0.0 110.513 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.69 104.15 13.57 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.1 t -51.46 127.19 19.32 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.24 1.019 . . . . 0.0 109.674 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.7 -34.54 5.41 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 10.8 m -105.75 -35.97 7.2 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.429 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.7 mm-40 55.3 56.4 6.44 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.682 1.23 . . . . 0.0 109.997 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -140.79 124.08 10.07 Favored Pre-proline 0 C--N 1.294 -1.815 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -44.14 135.15 8.45 Favored 'Trans proline' 0 N--CA 1.491 1.376 0 CA-C-N 120.433 1.19 . . . . 0.0 114.842 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.0 mt -93.83 98.41 8.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.427 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.2 p -98.97 91.34 4.99 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.191 -0.943 . . . . 0.0 111.349 -177.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.0 -96.76 0.16 Allowed Glycine 0 N--CA 1.487 2.07 0 N-CA-C 107.579 -2.209 . . . . 0.0 107.579 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.486 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.2 mmt-85 -111.77 151.95 28.4 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 23.7 p -144.57 126.45 15.35 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.902 -1.124 . . . . 0.0 111.512 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 44.8 mt -90.75 146.06 6.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.8 m -118.8 146.53 44.75 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.847 0.832 . . . . 0.0 109.009 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.726 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -129.29 0.26 Allowed 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.598 0.713 . . . . 0.0 109.287 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 3.1 mtt -66.29 26.69 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.726 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.27 -9.06 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.63 159.41 24.03 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . 0.404 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 16.9 mmmt -102.55 174.67 5.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 2.5 m-85 -160.29 132.85 6.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.236 -1.386 . . . . 0.0 110.225 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.537 ' ND1' ' ND1' ' B' ' 572' ' ' HIS . 9.6 m80 -53.88 113.81 5.51 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.597 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.88 -12.53 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.535 0 CA-C-N 120.458 1.199 . . . . 0.0 110.731 -178.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' B' ' 569' ' ' HIS . 7.5 mt-10 -91.86 -51.81 5.04 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 122.076 0.941 . . . . 0.0 110.243 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.537 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -61.48 -3.22 0.92 Allowed 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.168 -0.957 . . . . 0.0 109.896 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.1 t80 -132.19 59.21 1.72 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 17.9 m -94.59 177.76 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.931 0.872 . . . . 0.0 111.518 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.451 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.92 145.52 27.73 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.505 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.64 76.22 3.26 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 116.843 -1.943 . . . . 0.0 109.844 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -152.68 -52.48 0.11 Allowed 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 102.191 -3.263 . . . . 0.0 102.191 173.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.0 p -129.63 80.11 1.94 Allowed 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 111.437 -2.62 . . . . 0.0 104.47 176.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mt -52.43 16.11 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.836 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.52 -36.87 17.37 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 119.632 -1.917 . . . . 0.0 112.551 -178.673 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.05 140.14 12.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 119.611 -1.93 . . . . 0.0 114.653 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.451 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 22.2 tp -137.11 169.54 17.6 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.1 m-20 -147.09 131.24 17.35 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.313 -0.867 . . . . 0.0 109.229 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -52.58 -21.89 4.37 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.443 -0.785 . . . . 0.0 109.476 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.64 -17.31 64.13 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.64 26.95 3.38 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.82 108.51 19.74 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 122.729 1.252 . . . . 0.0 110.06 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.531 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.99 167.88 9.55 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.424 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.5 tt0 -153.15 156.3 38.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.808 -1.183 . . . . 0.0 110.373 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.528 ' CD ' HD22 ' B' ' 591' ' ' ASN . 7.8 tt0 -157.96 146.68 19.21 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 178.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.666 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 50.08 21.99 0.84 Allowed 'General case' 0 C--N 1.29 -1.997 0 O-C-N 121.182 -0.949 . . . . 0.0 109.26 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.1 m-20 81.2 -4.99 1.66 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.786 -0.571 . . . . 0.0 110.716 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . 0.412 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 33.4 mttm -91.36 118.98 68.77 Favored Pre-proline 0 C--N 1.295 -1.795 0 O-C-N 121.258 -0.901 . . . . 0.0 109.575 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.0 Cg_exo -49.23 166.44 0.18 Allowed 'Trans proline' 0 N--CA 1.488 1.171 0 CA-C-N 120.135 1.084 . . . . 0.0 111.494 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' B' ' 588' ' ' LYS . 21.9 m-85 -170.55 137.3 1.36 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.08 -1.012 . . . . 0.0 110.756 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 16.3 m -69.55 154.28 42.23 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 173.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.457 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.81 -56.68 19.04 Favored 'General case' 0 C--N 1.289 -2.046 0 C-N-CA 117.479 -1.689 . . . . 0.0 106.459 179.516 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -45.53 -26.53 0.6 Allowed 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.587 -0.696 . . . . 0.0 109.845 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 93.4 m -84.48 -65.4 1.01 Allowed 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.155 -0.965 . . . . 0.0 109.31 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -51.27 -56.66 11.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.497 -0.752 . . . . 0.0 109.38 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.472 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.31 -42.47 31.12 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.262 -0.898 . . . . 0.0 109.064 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -58.8 -20.27 48.64 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.366 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.87 -56.44 3.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.751 -1.218 . . . . 0.0 110.779 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.41 ' O ' ' C ' ' B' ' 605' ' ' CYS . 9.5 m-85 -107.43 32.35 4.74 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.414 -0.804 . . . . 0.0 109.924 -178.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.41 ' C ' ' O ' ' B' ' 604' ' ' PHE . 9.4 t . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.924 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 108.804 -1.718 . . . . 0.0 108.804 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -95.7 122.53 38.56 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.471 -1.017 . . . . 0.0 109.802 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.578 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -131.27 120.93 23.89 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.539 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.26 129.37 35.81 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.162 -0.961 . . . . 0.0 109.215 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.474 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.79 134.42 34.73 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.183 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.22 146.24 35.05 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.272 -0.893 . . . . 0.0 109.794 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -138.51 105.44 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 CA-C-O 121.786 0.803 . . . . 0.0 110.059 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.494 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 2.8 m80 -79.59 104.75 10.41 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -71.11 98.21 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.258 -0.901 . . . . 0.0 109.915 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -70.03 164.28 24.34 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.9 t70 72.09 -43.65 0.57 Allowed 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.543 ' H ' ' C ' ' A' ' 25' ' ' THR . 4.8 mt -93.25 -30.77 15.01 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.565 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 73.31 17.45 3.93 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.085 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtp85 -94.27 -178.73 4.7 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.899 -1.126 . . . . 0.0 109.142 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.494 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 9.9 m-20 -140.18 117.8 11.57 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.1 t -120.7 157.76 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.653 0.739 . . . . 0.0 110.013 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.06 135.36 45.3 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -113.53 111.59 22.15 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.511 -0.743 . . . . 0.0 109.322 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -61.11 102.45 0.21 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.9 m -129.95 -169.16 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 CA-C-O 121.936 0.874 . . . . 0.0 109.969 -178.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.429 ' C ' ' H ' ' A' ' 38' ' ' GLU . 16.7 p -139.32 169.59 17.49 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.578 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -77.13 44.66 2.17 Favored Glycine 0 N--CA 1.485 1.943 0 C-N-CA 119.386 -1.387 . . . . 0.0 109.634 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.429 ' H ' ' C ' ' A' ' 36' ' ' THR . 3.9 pt-20 -146.61 4.04 0.87 Allowed 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.608 -0.936 . . . . 0.0 108.795 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.9 m -88.17 137.19 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.67 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.8 m80 -76.1 146.78 39.08 Favored 'General case' 0 C--N 1.293 -1.865 0 O-C-N 120.942 -1.099 . . . . 0.0 108.689 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.414 HG21 HD11 ' A' ' 41' ' ' ILE . 97.7 mt -45.93 -58.64 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.964 . . . . 0.0 109.583 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.8 -16.82 8.08 Favored Glycine 0 C--N 1.297 -1.602 0 N-CA-C 108.496 -1.841 . . . . 0.0 108.496 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -69.34 -29.17 71.94 Favored Glycine 0 N--CA 1.483 1.772 0 N-CA-C 107.941 -2.063 . . . . 0.0 107.941 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 t -84.79 -39.81 14.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.49 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.0 mtm -46.68 -37.67 8.68 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.522 ' CG ' ' HH ' ' B' ' 595' ' ' TYR . 0.6 OUTLIER -78.22 -56.94 4.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.711 -0.618 . . . . 0.0 110.641 -178.514 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -53.03 -59.85 4.03 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.794 -1.191 . . . . 0.0 110.738 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.68 -44.92 13.84 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.153 -0.967 . . . . 0.0 109.364 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 39.9 t -68.27 -48.01 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.514 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -45.08 -39.24 5.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 0.0 109.866 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.535 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.7 mtmp? -75.93 -28.38 57.98 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.347 -0.846 . . . . 0.0 110.447 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.409 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 11.1 tp -60.99 -65.93 0.61 Allowed 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.084 -1.01 . . . . 0.0 108.878 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.2 t70 75.53 77.95 0.1 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.909 0.862 . . . . 0.0 110.422 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.567 ' C ' ' H ' ' A' ' 56' ' ' LYS . 3.0 p -175.05 126.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.007 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.1 tptt -65.0 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 109.873 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.567 ' H ' ' C ' ' A' ' 54' ' ' VAL . 4.5 ttpm? -77.66 161.23 27.94 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.041 -1.037 . . . . 0.0 108.701 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.418 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -66.71 93.37 0.25 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.296 -0.877 . . . . 0.0 109.38 -179.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.528 ' CZ2' ' O ' ' A' ' 54' ' ' VAL . 16.7 m0 -83.77 -46.49 12.17 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.839 0.828 . . . . 0.0 109.029 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.8 m -42.69 -55.19 3.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.299 -0.876 . . . . 0.0 110.47 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -50.5 -23.35 2.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.407 -0.808 . . . . 0.0 110.215 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.467 ' CB ' ' CZ ' ' A' ' 92' ' ' PHE . 21.9 m-70 -90.89 160.05 15.9 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.998 -1.064 . . . . 0.0 111.864 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.26 170.56 13.07 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -94.36 146.23 24.2 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.6 -1.313 . . . . 0.0 110.07 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.577 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -129.86 151.57 50.29 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.07 93.77 4.65 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.108 -0.995 . . . . 0.0 108.782 -179.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -55.48 -23.83 27.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.29 -0.881 . . . . 0.0 110.771 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.496 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.9 mmtp -67.51 -10.14 48.86 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 178.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -133.48 -12.04 2.74 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.984 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.5 mpp_? 52.28 46.18 27.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 -178.088 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -114.01 -171.15 1.85 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.607 0.717 . . . . 0.0 110.071 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.452 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -126.1 103.64 7.82 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 177.357 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.02 86.84 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.27 0 O-C-N 120.507 -1.371 . . . . 0.0 111.15 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.37 9.31 10.32 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.499 ' C ' ' H ' ' A' ' 76' ' ' HIS . 5.6 mmpt? -77.65 54.18 1.18 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.679 -0.638 . . . . 0.0 110.029 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.1 p -59.13 -5.99 0.79 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.864 -1.147 . . . . 0.0 108.769 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.499 ' H ' ' C ' ' A' ' 74' ' ' LYS . 36.1 m80 -59.41 -40.78 87.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.519 -0.738 . . . . 0.0 110.971 -179.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -121.18 -162.46 0.97 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.557 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -120.24 -164.17 1.07 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.973 -1.079 . . . . 0.0 110.481 -178.257 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.539 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.1 mp -71.63 -59.26 2.85 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -47.01 -52.67 14.26 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.018 0.914 . . . . 0.0 109.72 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.557 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.4 mmtt -45.31 -55.06 6.33 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.674 0.75 . . . . 0.0 109.664 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -71.35 -43.62 66.61 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.256 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.37 4.21 8.38 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 108.819 -1.713 . . . . 0.0 108.819 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.52 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 38.4 mt -61.69 161.05 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 O-C-N 121.582 -0.952 . . . . 0.0 109.35 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -172.13 -161.96 0.19 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.361 -0.837 . . . . 0.0 109.143 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.83 -23.98 60.84 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.504 -0.748 . . . . 0.0 109.482 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -74.5 -11.92 60.35 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.474 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.46 113.15 25.34 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.9 mmtp -94.78 118.12 31.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.911 -1.118 . . . . 0.0 109.69 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.0 mt -94.41 175.99 6.47 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.561 0.696 . . . . 0.0 109.332 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.577 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -134.87 161.38 35.4 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 61.8 t80 -120.42 91.23 3.49 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.507 2.386 0 O-C-N 121.848 -0.533 . . . . 0.0 110.291 -177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.533 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m . . . . . 0 N--CA 1.487 1.395 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -58.13 134.4 56.43 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 120.942 -1.099 . . . . 0.0 110.713 -178.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.8 104.0 12.71 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.866 -1.901 . . . . 0.0 105.866 178.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.0 t -48.7 124.75 8.86 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 122.034 0.921 . . . . 0.0 109.318 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 110.23 -37.21 3.86 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.8 m -101.86 -35.99 8.82 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.418 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 55.35 56.41 6.4 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.815 1.293 . . . . 0.0 109.427 -178.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -140.45 122.44 9.61 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.23 133.46 9.02 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 CA-C-N 120.539 1.228 . . . . 0.0 114.504 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.533 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -92.04 98.15 8.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.66 91.14 4.73 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.992 0.901 . . . . 0.0 111.238 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.07 -96.36 0.15 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 107.283 -2.327 . . . . 0.0 107.283 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.475 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.8 mmt-85 -112.39 149.86 31.92 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -145.04 126.64 15.11 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.911 -1.118 . . . . 0.0 111.521 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 43.0 mt -91.4 146.41 6.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.6 m -120.13 146.39 46.01 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.873 0.844 . . . . 0.0 108.945 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.752 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.74 -129.22 0.26 Allowed 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.551 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.88 25.94 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 109.245 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.752 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.99 -8.13 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -178.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 150.63 28.11 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . 0.414 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 18.2 mmmt -96.49 174.72 6.71 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . 0.414 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 0.9 OUTLIER -162.27 132.07 4.58 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 117.568 -1.653 . . . . 0.0 111.31 -178.607 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.592 ' O ' ' N ' ' B' ' 571' ' ' GLU . 2.6 m80 -50.59 112.27 2.76 Favored Pre-proline 0 C--N 1.297 -1.687 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 176.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.461 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 51.1 Cg_exo -44.62 -4.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.415 0 CA-C-N 120.186 1.102 . . . . 0.0 114.395 -178.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.592 ' N ' ' O ' ' B' ' 569' ' ' HIS . 5.8 mt-10 -112.16 -53.66 2.69 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 122.749 1.261 . . . . 0.0 108.814 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -46.78 -15.15 0.03 OUTLIER 'General case' 0 C--N 1.285 -2.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.453 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.519 ' N ' ' O ' ' B' ' 571' ' ' GLU . 55.1 t80 -118.53 54.08 0.96 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . 0.438 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 14.1 m -91.83 176.13 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.468 ' CB ' ' SG ' ' B' ' 596' ' ' CYS . 0.0 OUTLIER -71.39 141.2 50.35 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . 0.49 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.87 74.88 6.48 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 116.377 -2.129 . . . . 0.0 108.486 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -150.85 -60.58 0.18 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 100.839 -3.763 . . . . 0.0 100.839 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.6 OUTLIER -104.8 155.28 19.04 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 176.156 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . 0.67 ' H ' ' CD2' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -105.55 14.21 28.88 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.033 -1.042 . . . . 0.0 111.265 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -102.86 -38.99 7.16 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.461 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.1 tp60 -162.42 142.0 9.46 Favored 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 122.447 2.385 . . . . 0.0 115.979 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.453 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 22.7 tp -137.41 168.4 19.72 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 174.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.8 m-20 -150.54 133.85 16.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.859 -1.15 . . . . 0.0 109.843 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -50.39 -18.85 0.7 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.563 0.697 . . . . 0.0 109.697 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.76 -21.26 51.33 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 586' ' ' THR . . . . . 0.449 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.5 p -134.62 26.79 3.71 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.58 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.65 108.37 19.77 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 122.589 1.185 . . . . 0.0 110.256 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.73 169.85 8.37 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.063 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.422 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.7 tt0 -151.34 157.19 42.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.653 -1.279 . . . . 0.0 110.832 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.621 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.7 OUTLIER -153.22 146.07 24.42 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.527 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.03 23.54 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.057 -1.027 . . . . 0.0 110.064 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.487 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.2 m-20 82.66 -4.82 1.35 Allowed 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.811 -0.556 . . . . 0.0 110.702 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 39.1 mttm -91.57 124.54 60.54 Favored Pre-proline 0 C--N 1.295 -1.787 0 O-C-N 121.302 -0.874 . . . . 0.0 109.698 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.492 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.8 Cg_exo -49.09 163.64 0.32 Allowed 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 119.971 1.025 . . . . 0.0 112.479 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.522 ' HH ' ' CG ' ' A' ' 46' ' ' LEU . 13.5 m-85 -170.73 141.69 1.86 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.335 -0.853 . . . . 0.0 109.796 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . 0.468 ' SG ' ' CB ' ' B' ' 575' ' ' CYS . 6.0 m -74.49 157.05 36.23 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.439 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.83 -57.31 13.21 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 179.1 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.56 -30.18 2.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.454 -0.778 . . . . 0.0 108.936 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 8.6 m -79.43 -62.56 1.65 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.545 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.3 OUTLIER -56.73 -55.96 27.51 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-O 121.15 0.5 . . . . 0.0 110.585 -179.685 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.545 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -47.66 -42.16 23.96 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.228 -0.92 . . . . 0.0 109.091 -178.566 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 28.3 tttt -59.67 -20.9 59.27 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.187 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 6.6 mt -90.6 -56.74 3.08 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.131 -0.98 . . . . 0.0 111.509 -178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.621 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.2 m-85 -89.37 30.64 0.97 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.874 -1.141 . . . . 0.0 110.396 -178.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.503 ' SG ' ' O ' ' B' ' 601' ' ' LEU . 3.2 m . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.912 -1.117 . . . . 0.0 109.291 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.486 2.028 0 N-CA-C 108.168 -1.973 . . . . 0.0 108.168 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.632 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 12.4 p -79.45 129.62 34.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.481 -1.011 . . . . 0.0 109.648 -179.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.548 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -153.04 137.67 16.88 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -90.38 132.3 35.68 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.014 -1.053 . . . . 0.0 110.1 -179.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.524 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.42 134.2 34.48 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.27 145.73 35.25 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.169 -0.957 . . . . 0.0 108.69 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.2 t -138.51 106.7 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-O 121.78 0.8 . . . . 0.0 110.193 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.521 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 16.4 m170 -82.11 103.97 12.11 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.543 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -73.97 108.61 5.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 118.654 -1.219 . . . . 0.0 108.22 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.89 -23.46 38.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 109.057 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -78.84 -8.33 58.71 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.1 mt -130.15 -21.06 2.99 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.543 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.98 12.55 2.26 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 122.033 -0.417 . . . . 0.0 110.143 -179.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 16.5 mtp-105 -98.3 -178.12 3.93 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 121.03 -1.044 . . . . 0.0 109.856 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.521 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 20.3 m-20 -135.97 116.68 13.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.6 t -115.93 158.04 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-O 121.626 0.727 . . . . 0.0 109.772 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.72 131.05 40.81 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -115.45 118.11 32.26 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.632 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -60.41 139.59 57.61 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 178.459 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.421 ' CG1' ' O ' ' A' ' 34' ' ' ARG . 5.5 m -160.26 -175.16 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.443 0 CA-C-O 121.882 0.849 . . . . 0.0 109.741 -177.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 p -140.49 173.05 11.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.97 49.74 4.02 Favored Glycine 0 C--N 1.29 -2.009 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -153.5 1.69 0.26 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.76 -0.847 . . . . 0.0 109.356 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -85.8 151.41 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.717 -1.239 . . . . 0.0 108.303 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.569 ' CD2' ' H ' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -87.67 142.75 27.59 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 121.235 -0.916 . . . . 0.0 109.17 179.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.464 ' C ' ' H ' ' A' ' 43' ' ' GLY . 38.6 mt -47.16 -57.81 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-O 122.179 0.99 . . . . 0.0 109.222 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.69 -14.36 3.71 Favored Glycine 0 C--N 1.295 -1.733 0 N-CA-C 108.512 -1.835 . . . . 0.0 108.512 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.79 -25.48 62.48 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -79.58 -55.09 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.413 -1.051 . . . . 0.0 109.757 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -21.95 4.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.449 -1.407 . . . . 0.0 108.585 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tt -71.69 -58.32 3.59 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -61.76 -51.87 66.56 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.306 -0.871 . . . . 0.0 110.625 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.3 tp -44.82 -54.24 6.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.089 -1.007 . . . . 0.0 110.604 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.88 -44.06 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 120.722 -1.236 . . . . 0.0 110.098 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -45.01 -38.45 4.81 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.125 -0.985 . . . . 0.0 109.986 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.532 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.3 mtmp? -67.91 -48.5 65.81 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.381 -0.824 . . . . 0.0 110.421 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.8 OUTLIER -65.0 -68.11 0.39 Allowed 'General case' 0 C--N 1.307 -1.262 0 O-C-N 120.877 -1.139 . . . . 0.0 108.33 179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 10.2 t0 80.36 88.23 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.119 0.962 . . . . 0.0 110.377 178.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.523 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -169.78 140.12 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.285 -2.223 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.276 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -67.32 35.54 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.639 -0.663 . . . . 0.0 110.567 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.523 ' H ' ' C ' ' A' ' 54' ' ' VAL . 13.6 ttmm -78.81 144.9 34.64 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 118.385 -1.326 . . . . 0.0 108.85 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.526 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 4.4 m-20 -54.73 96.11 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.628 -0.67 . . . . 0.0 110.073 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.477 ' O ' ' N ' ' A' ' 61' ' ' HIS . 47.6 m95 -107.21 -29.64 9.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.329 -0.857 . . . . 0.0 109.612 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 p -44.33 -42.89 7.11 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.617 -0.677 . . . . 0.0 110.149 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 15.7 t0 -75.1 -15.87 60.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.385 -0.822 . . . . 0.0 109.621 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.526 ' CE1' ' O ' ' A' ' 57' ' ' ASP . 2.4 m80 -85.18 128.36 34.64 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.209 -0.932 . . . . 0.0 110.789 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -139.3 176.82 8.38 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.576 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.7 mm? -94.75 145.12 25.09 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.818 -1.176 . . . . 0.0 110.304 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.516 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.21 151.53 49.15 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.539 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.84 94.7 5.08 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.078 -1.014 . . . . 0.0 108.97 -179.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.401 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 10.4 pt-20 -56.04 -23.69 34.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.23 -0.919 . . . . 0.0 110.762 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.506 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.9 mmtp -68.39 -9.57 49.21 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 178.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' A' ' 66' ' ' GLU . 16.5 mmtt -133.27 -12.14 2.8 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.983 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.539 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.65 46.65 26.32 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.8 t -115.06 -170.73 1.81 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.313 0.578 . . . . 0.0 109.774 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.532 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.55 97.42 4.54 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.525 -1.657 . . . . 0.0 106.525 177.212 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 11.1 mt -60.85 85.32 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.901 -1.124 . . . . 0.0 110.05 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -119.97 10.27 11.46 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.482 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -91.54 68.52 5.7 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.427 -0.796 . . . . 0.0 109.398 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.417 ' O ' ' O ' ' B' ' 605' ' ' CYS . 3.7 m -60.24 -5.51 1.13 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.995 -1.065 . . . . 0.0 108.968 179.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.482 ' H ' ' C ' ' A' ' 74' ' ' LYS . 40.1 m80 -59.27 -61.75 2.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.836 . . . . 0.0 112.099 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -88.07 -159.01 0.5 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.689 -1.257 . . . . 0.0 110.852 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.6 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -139.23 165.27 27.62 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.92 -1.113 . . . . 0.0 110.24 -178.208 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 11.1 mp -38.95 -65.4 0.37 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.076 0.941 . . . . 0.0 109.721 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -44.49 -52.29 8.04 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.852 0.834 . . . . 0.0 110.259 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.6 ' CG ' ' H ' ' A' ' 78' ' ' THR . 40.9 mmtt -45.25 -54.65 6.76 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.46 0.648 . . . . 0.0 109.722 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.86 -43.85 57.34 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.098 -1.041 . . . . 0.0 108.908 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 119.13 11.64 7.4 Favored Glycine 0 N--CA 1.5 2.913 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.55 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 33.7 mt -61.21 161.19 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.574 -0.957 . . . . 0.0 108.866 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -161.99 -169.15 2.11 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.297 -0.877 . . . . 0.0 109.239 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.91 -19.97 63.38 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.614 -0.679 . . . . 0.0 109.562 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.3 p30 -80.47 -8.26 59.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.289 -0.882 . . . . 0.0 109.184 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.524 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -93.07 113.35 25.59 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -93.28 115.88 28.46 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.767 -1.208 . . . . 0.0 109.551 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.9 mt -97.55 176.99 5.65 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.698 0.761 . . . . 0.0 109.507 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.516 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -132.81 168.59 18.11 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.194 -1.409 . . . . 0.0 107.194 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -133.31 99.35 4.5 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.23 0 C-N-CA 120.214 -0.595 . . . . 0.0 111.642 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m . . . . . 0 N--CA 1.488 1.447 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -59.03 135.04 57.5 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.783 -1.198 . . . . 0.0 110.211 -178.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.62 103.73 13.17 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.6 t -48.82 125.1 9.6 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-O 122.035 0.921 . . . . 0.0 109.639 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.5 -34.62 5.38 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 106.479 -2.648 . . . . 0.0 106.479 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.3 m -105.31 -35.26 7.6 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.3 mm-40 54.55 56.42 6.84 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.824 1.297 . . . . 0.0 109.881 -178.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -140.71 123.62 9.92 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -44.24 134.09 8.94 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 CA-C-N 120.574 1.241 . . . . 0.0 114.433 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.3 mt -91.74 98.31 8.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.429 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.5 p -99.46 91.01 4.72 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.286 -0.884 . . . . 0.0 111.159 -177.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.74 -96.2 0.15 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.462 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.6 mmt-85 -113.88 150.58 33.44 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 177.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 26.5 p -144.46 126.66 15.67 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.951 -1.093 . . . . 0.0 111.76 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 40.9 mt -91.32 146.68 5.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 12.2 m -120.72 146.53 46.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 121.81 0.814 . . . . 0.0 108.897 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.763 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.7 -129.02 0.26 Allowed 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.5 mtp -65.79 25.89 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.559 -0.713 . . . . 0.0 109.147 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.763 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.11 -8.51 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 -178.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.25 148.7 28.24 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -95.94 174.65 6.83 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.49 137.57 8.04 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.142 -1.423 . . . . 0.0 110.121 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.612 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.0 m80 -57.9 117.05 16.65 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.514 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.4 Cg_exo -44.11 -8.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.302 0 CA-C-N 120.114 1.076 . . . . 0.0 112.758 -178.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.612 ' N ' ' O ' ' B' ' 569' ' ' HIS . 8.2 mt-10 -106.41 -53.16 2.67 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 122.149 0.976 . . . . 0.0 109.623 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.47 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 15.4 m170 -55.5 -5.0 0.11 Allowed 'General case' 0 C--N 1.292 -1.927 0 O-C-N 120.312 -1.493 . . . . 0.0 109.495 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.54 ' H ' ' C ' ' B' ' 571' ' ' GLU . 39.8 t80 -125.44 52.96 1.58 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 11.6 m -92.93 177.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.453 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -80.39 141.85 34.95 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.53 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.4 75.6 3.89 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 116.842 -1.943 . . . . 0.0 109.915 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -153.33 -54.12 0.11 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 102.459 -3.163 . . . . 0.0 102.459 173.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.521 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.7 p -126.75 77.75 1.74 Allowed 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 111.68 -2.509 . . . . 0.0 104.396 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.3 mp -53.04 16.85 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.521 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.1 -37.71 21.67 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 119.545 -1.972 . . . . 0.0 112.233 -178.718 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -161.54 143.89 11.92 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 119.54 -1.975 . . . . 0.0 113.843 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.453 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.5 tp -136.62 170.59 15.82 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' B' ' 587' ' ' PHE . 70.3 m-20 -149.61 131.79 15.44 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.182 -0.949 . . . . 0.0 109.455 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -51.11 -19.16 1.03 Allowed 'General case' 0 C--N 1.302 -1.494 0 CA-C-O 121.564 0.697 . . . . 0.0 109.813 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.0 -20.54 55.28 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -134.34 26.62 3.8 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.52 107.73 19.35 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 122.657 1.218 . . . . 0.0 110.389 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.97 166.25 10.56 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.428 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.1 tt0 -153.01 157.28 40.3 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.815 -1.178 . . . . 0.0 110.653 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.503 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.6 tp-100 -156.22 146.13 21.2 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.573 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 46.41 23.65 0.24 Allowed 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.041 -1.037 . . . . 0.0 109.643 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 81.55 -5.74 1.55 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.782 -0.574 . . . . 0.0 110.8 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -88.34 116.25 65.67 Favored Pre-proline 0 C--N 1.294 -1.806 0 O-C-N 121.206 -0.934 . . . . 0.0 109.54 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.515 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 42.6 Cg_exo -49.51 164.2 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 CA-C-N 119.908 1.003 . . . . 0.0 112.141 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.515 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.77 140.03 1.6 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.179 -0.951 . . . . 0.0 110.163 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 11.0 m -73.51 152.88 40.53 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 174.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.437 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -55.69 -57.46 11.9 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -45.35 -29.44 1.05 Allowed 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.58 -0.7 . . . . 0.0 109.316 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 76.2 m -84.62 -66.17 0.92 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.611 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -43.86 -56.5 3.84 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.656 0.741 . . . . 0.0 109.577 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.611 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -51.73 -43.31 62.83 Favored 'General case' 0 C--N 1.293 -1.854 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -178.802 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -64.69 -20.48 66.34 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.705 -1.247 . . . . 0.0 110.807 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -90.17 -56.46 3.21 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.3 -1.5 . . . . 0.0 112.067 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.29 30.73 4.37 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.223 -0.923 . . . . 0.0 112.381 -176.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.417 ' O ' ' O ' ' A' ' 75' ' ' THR . 2.4 t . . . . . 0 N--CA 1.5 2.058 0 O-C-N 120.604 -1.31 . . . . 0.0 108.805 178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.531 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.494 2.529 0 N-CA-C 108.443 -1.863 . . . . 0.0 108.443 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.92 122.4 23.37 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.568 -0.96 . . . . 0.0 109.532 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.531 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -133.01 124.55 27.9 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.535 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.12 128.71 34.21 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.819 -1.176 . . . . 0.0 109.134 -179.798 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.477 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -84.01 133.35 34.68 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.573 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.55 145.5 34.8 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.396 -0.815 . . . . 0.0 110.019 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.8 t -135.2 100.42 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.762 0.792 . . . . 0.0 109.066 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.534 ' CE1' ' OD1' ' A' ' 30' ' ' ASP . 7.7 m-70 -77.94 104.06 8.26 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 28' ' ' ASN . 4.8 t -74.75 117.88 19.62 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.128 -1.429 . . . . 0.0 108.965 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.27 -23.6 28.11 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.371 -0.831 . . . . 0.0 109.72 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.481 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -79.92 -8.86 59.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.0 108.373 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.404 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.0 mt -129.0 -23.62 3.02 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.523 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.22 12.11 2.78 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 -179.42 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -94.92 -177.96 4.34 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.197 -0.939 . . . . 0.0 109.445 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.534 ' OD1' ' CE1' ' A' ' 23' ' ' HIS . 2.1 m-20 -136.7 113.19 10.06 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.76 157.48 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.2 139.79 47.19 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.41 ' CD1' ' NZ ' ' A' ' 51' ' ' LYS . 2.3 mm? -120.16 112.55 19.23 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.663 -0.648 . . . . 0.0 109.56 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -61.47 107.01 0.72 Allowed 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -135.33 -168.94 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 CA-C-O 121.842 0.83 . . . . 0.0 110.339 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.409 ' H ' HG13 ' A' ' 39' ' ' VAL . 1.6 p -141.84 173.35 11.59 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.17 44.52 2.65 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.2 OUTLIER -144.67 2.95 1.09 Allowed 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.615 -0.932 . . . . 0.0 108.843 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.409 HG13 ' H ' ' A' ' 36' ' ' THR . 2.9 m -89.08 135.21 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 O-C-N 121.146 -0.971 . . . . 0.0 110.259 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.498 ' O ' ' N ' ' A' ' 43' ' ' GLY . 9.4 m-70 -78.4 148.2 33.75 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.921 -1.112 . . . . 0.0 108.866 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.474 ' C ' ' H ' ' A' ' 43' ' ' GLY . 38.7 mt -47.36 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.131 -0.981 . . . . 0.0 109.251 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.56 -13.36 2.87 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 108.625 -1.79 . . . . 0.0 108.625 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -82.23 -26.94 46.28 Favored Glycine 0 N--CA 1.483 1.833 0 N-CA-C 109.261 -1.536 . . . . 0.0 109.261 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.7 t -80.79 -55.26 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -1.105 . . . . 0.0 109.543 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.56 -40.58 38.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.766 -1.209 . . . . 0.0 108.996 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.8 tt -54.47 -58.88 5.73 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.079 -1.013 . . . . 0.0 109.35 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -59.39 -57.84 11.22 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.246 -0.909 . . . . 0.0 110.919 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.5 tp -44.81 -41.73 7.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.366 -0.834 . . . . 0.0 110.182 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 53' ' ' ASP . 93.2 t -74.67 -43.49 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.821 -1.174 . . . . 0.0 109.52 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -45.79 -38.87 7.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.257 -0.902 . . . . 0.0 108.933 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.41 ' NZ ' ' CD1' ' A' ' 33' ' ' LEU . 54.5 mttp -67.44 -57.38 6.66 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.479 -0.763 . . . . 0.0 109.294 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.568 ' C ' ' H ' ' A' ' 54' ' ' VAL . 3.8 mm? -67.78 -66.22 0.59 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.523 ' N ' ' O ' ' A' ' 49' ' ' VAL . 2.8 t70 78.0 -34.02 0.18 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.875 0.845 . . . . 0.0 109.627 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.568 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.4 p -20.15 134.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.169 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.481 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.453 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.3 tttt -69.9 36.42 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.133 -0.98 . . . . 0.0 110.457 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.533 ' H ' ' C ' ' A' ' 54' ' ' VAL . 3.2 ttpm? -83.97 169.21 15.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.919 . . . . 0.0 108.531 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.535 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -79.71 123.54 27.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.021 -1.049 . . . . 0.0 109.545 -179.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.651 ' CZ3' ' CZ ' ' A' ' 92' ' ' PHE . 93.3 m95 -119.09 -48.54 2.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.453 -0.779 . . . . 0.0 109.934 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 p -45.51 -55.97 5.61 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.15 -0.968 . . . . 0.0 109.913 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -55.17 -32.17 61.95 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.535 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 8.8 m-70 -83.55 168.74 16.13 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.981 0.896 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.58 178.57 4.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.587 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -94.24 148.59 22.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.87 -1.144 . . . . 0.0 108.863 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.514 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.35 151.32 48.92 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.54 94.01 4.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.626 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -55.12 -24.2 24.86 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.316 -0.865 . . . . 0.0 111.028 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.511 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.4 mmtp -68.43 -8.81 43.99 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -133.76 -12.89 2.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.783 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 52.68 45.83 27.89 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -178.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -111.86 -173.61 2.28 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.311 0.577 . . . . 0.0 109.732 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.51 5.66 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 177.551 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 35.2 mt -59.81 82.6 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.047 0 O-C-N 120.661 -1.274 . . . . 0.0 110.745 -176.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.553 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -115.38 4.62 14.4 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.539 ' NZ ' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -80.59 72.08 7.49 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' HIS . 46.5 m -44.74 -53.09 7.72 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.204 -0.935 . . . . 0.0 109.742 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.425 ' O ' ' O ' ' A' ' 75' ' ' THR . 45.5 m-70 -51.9 -179.31 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.362 -0.836 . . . . 0.0 109.134 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 23.3 m0 55.92 173.65 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.741 0.781 . . . . 0.0 109.124 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.643 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -131.2 -164.6 1.46 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.681 0.753 . . . . 0.0 109.24 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.541 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.1 mp -70.68 -58.4 3.69 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -43.77 -52.4 6.64 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.67 0.748 . . . . 0.0 109.702 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.643 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.0 mmtt -46.11 -54.43 8.59 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.628 0.727 . . . . 0.0 109.558 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.539 ' OH ' ' NZ ' ' A' ' 74' ' ' LYS . 2.2 m-85 -72.59 -42.05 64.98 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.143 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.19 6.1 14.07 Favored Glycine 0 N--CA 1.5 2.966 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.514 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 52.0 mt -61.63 161.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.765 -0.844 . . . . 0.0 109.784 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -172.05 -162.91 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.19 70.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.368 -0.832 . . . . 0.0 109.956 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.416 ' OD2' ' O ' ' A' ' 87' ' ' ASP . 1.0 OUTLIER -68.42 -13.19 62.12 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -96.81 112.56 24.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -96.23 116.21 28.64 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.928 -1.107 . . . . 0.0 109.594 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.8 mt -91.99 175.73 6.76 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.514 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.7 mt-30 -134.68 160.34 38.44 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.651 ' CZ ' ' CZ3' ' A' ' 58' ' ' TRP . 0.1 OUTLIER -119.16 96.45 5.23 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.503 2.197 0 O-C-N 121.858 -0.526 . . . . 0.0 110.266 -177.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.604 ' H ' ' H ' ' B' ' 556' ' ' ILE . 1.7 m . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.6 mp -58.45 133.81 56.1 Favored 'General case' 0 C--N 1.293 -1.85 0 O-C-N 120.696 -1.253 . . . . 0.0 110.74 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 104.08 13.44 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 178.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.1 t -50.84 126.66 16.51 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 122.23 1.014 . . . . 0.0 109.728 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.37 5.5 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 106.216 -2.753 . . . . 0.0 106.216 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.7 m -105.72 -36.15 7.15 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.421 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.8 mm-40 55.65 56.2 6.42 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 122.719 1.247 . . . . 0.0 110.015 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -140.63 123.92 10.15 Favored Pre-proline 0 N--CA 1.497 1.88 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -44.07 133.94 8.52 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 CA-C-N 120.536 1.227 . . . . 0.0 114.488 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.604 ' H ' ' H ' ' B' ' 547' ' ' SER . 36.9 mt -91.85 98.53 8.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.77 92.13 5.17 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.203 -0.936 . . . . 0.0 111.338 -178.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.27 -95.24 0.15 Allowed Glycine 0 N--CA 1.488 2.118 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 10.0 mmt180 -114.2 151.13 33.23 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.1 p -144.45 126.25 15.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.944 -1.097 . . . . 0.0 111.676 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 41.0 mt -91.43 146.77 5.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.618 ' N ' ' HZ2' ' B' ' 584' ' ' LYS . 8.6 m -117.61 146.6 43.53 Favored 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.762 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.2 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.61 0.719 . . . . 0.0 109.389 -178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.549 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.9 mtp -65.96 26.44 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.762 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.12 -8.96 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 -178.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -82.14 161.92 22.65 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -103.77 174.66 5.77 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -161.09 135.07 6.89 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 118.03 -1.468 . . . . 0.0 110.089 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.586 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.8 m80 -55.53 116.0 10.79 Favored Pre-proline 0 C--N 1.301 -1.533 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.53 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 41.8 Cg_exo -46.46 -9.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.384 0 CA-C-N 120.27 1.132 . . . . 0.0 111.642 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.586 ' N ' ' O ' ' B' ' 569' ' ' HIS . 10.4 mt-10 -99.75 -52.41 3.46 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.418 1.104 . . . . 0.0 109.738 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.47 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.6 m170 -59.06 -3.2 0.33 Allowed 'General case' 0 C--N 1.289 -2.028 0 O-C-N 120.41 -1.432 . . . . 0.0 109.618 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.527 ' H ' ' C ' ' B' ' 571' ' ' GLU . 23.2 t80 -132.38 58.86 1.74 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . 0.409 HG11 ' O ' ' B' ' 571' ' ' GLU . 7.7 m -93.91 177.98 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.659 0.742 . . . . 0.0 110.777 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.484 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -75.52 145.64 41.17 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.95 75.7 3.11 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 116.661 -2.015 . . . . 0.0 109.935 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.1 -61.61 0.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 102.264 -3.236 . . . . 0.0 102.264 173.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.542 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.3 p -118.41 82.78 1.9 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 111.881 -2.418 . . . . 0.0 105.069 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mp -52.66 16.36 0.0 OUTLIER 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.75 -36.82 21.5 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 119.573 -1.954 . . . . 0.0 112.78 -178.153 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.53 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.2 tp60 -161.9 142.13 10.33 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 119.262 -2.149 . . . . 0.0 114.941 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.484 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 19.5 tp -140.38 167.63 21.7 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.526 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.7 m-20 -150.8 134.78 16.73 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.236 -0.915 . . . . 0.0 109.235 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.618 ' HZ2' ' N ' ' B' ' 562' ' ' THR . 1.8 ptpp? -52.58 -18.65 1.84 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.229 -0.919 . . . . 0.0 109.292 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.46 -18.19 57.43 Favored Glycine 0 N--CA 1.485 1.938 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 586' ' ' THR . . . . . 0.4 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.4 p -135.68 25.17 3.4 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.906 -0.761 . . . . 0.0 108.989 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.554 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -91.08 109.08 20.32 Favored 'General case' 0 N--CA 1.501 2.078 0 CA-C-O 122.564 1.173 . . . . 0.0 110.029 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -105.7 169.91 8.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 107.516 -1.291 . . . . 0.0 107.516 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.425 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.2 tt0 -152.62 157.19 40.63 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.737 -1.227 . . . . 0.0 110.616 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.503 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -157.1 146.52 20.35 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.606 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 47.89 22.93 0.41 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.923 -1.11 . . . . 0.0 109.59 -179.323 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.473 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 81.81 -7.03 1.43 Allowed 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.789 -0.57 . . . . 0.0 111.234 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . 0.402 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 38.3 mttm -89.59 121.07 69.5 Favored Pre-proline 0 C--N 1.297 -1.711 0 O-C-N 121.033 -1.042 . . . . 0.0 109.711 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.537 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.5 Cg_exo -49.61 164.18 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.235 0 CA-C-N 120.174 1.098 . . . . 0.0 111.656 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.537 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.6 m-85 -170.28 139.95 1.81 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.242 -0.911 . . . . 0.0 109.873 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 3.8 m -69.69 154.08 42.49 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 175.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.422 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.09 -57.59 12.39 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 178.357 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.8 -29.68 1.41 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 4.6 m -82.43 -67.55 0.78 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.639 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.32 -59.16 3.1 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.523 0.678 . . . . 0.0 110.224 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.639 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -50.44 -42.7 54.53 Favored 'General case' 0 C--N 1.293 -1.851 0 O-C-N 121.539 -0.725 . . . . 0.0 109.429 -178.567 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 8.7 tptp -62.78 -22.84 66.89 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.089 -1.007 . . . . 0.0 111.199 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.92 -44.69 8.32 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.325 -1.484 . . . . 0.0 110.26 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.447 ' O ' ' C ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -120.06 32.85 5.85 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.528 -0.733 . . . . 0.0 109.831 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.447 ' C ' ' O ' ' B' ' 604' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.503 2.2 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.502 0 N-CA-C 108.542 -1.823 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.5 p -93.92 122.07 36.04 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.551 -0.97 . . . . 0.0 109.475 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.404 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -125.78 123.51 38.94 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.535 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.23 129.99 34.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 108.807 -179.806 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.446 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.34 131.46 35.06 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.66 34.68 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.287 -0.883 . . . . 0.0 110.098 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 33.1 t -136.39 106.96 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 CA-C-O 121.67 0.747 . . . . 0.0 109.21 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.502 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 5.9 m170 -77.81 103.43 7.75 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 178.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.1 t -69.35 107.38 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.621 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' LEU . 11.5 p -74.27 -65.31 0.86 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.542 -0.724 . . . . 0.0 111.122 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' OG1' ' A' ' 25' ' ' THR . 19.3 t0 -46.9 -13.15 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.088 -1.007 . . . . 0.0 110.027 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.549 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.5 mm? -112.12 -48.03 3.07 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.424 -0.797 . . . . 0.0 109.062 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER 98.02 13.06 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -177.531 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.1 mtp-105 -94.77 -176.85 4.0 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.125 0.965 . . . . 0.0 109.702 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.502 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 2.4 m-20 -138.34 116.02 11.41 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.6 t -113.15 155.96 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-O 121.532 0.682 . . . . 0.0 109.341 -179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.56 133.92 40.79 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -113.85 113.16 24.51 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -60.26 107.58 0.67 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.4 m -134.5 -169.77 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.822 0.82 . . . . 0.0 110.114 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.9 p -142.61 173.25 11.7 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.404 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -78.89 46.61 2.95 Favored Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -148.57 4.89 0.69 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.675 -0.897 . . . . 0.0 108.982 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.3 m -90.49 144.31 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.01 -1.057 . . . . 0.0 110.174 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.492 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 p-80 -84.47 146.45 27.6 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.924 -1.11 . . . . 0.0 108.797 178.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 68.3 mt -48.93 -53.68 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 120.937 -1.102 . . . . 0.0 108.683 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.72 -15.32 4.49 Favored Glycine 0 N--CA 1.485 1.945 0 N-CA-C 108.148 -1.981 . . . . 0.0 108.148 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -76.85 -30.62 55.67 Favored Glycine 0 N--CA 1.483 1.777 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -83.71 -43.47 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.61 -0.935 . . . . 0.0 108.62 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.58 -37.67 12.87 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.112 -0.992 . . . . 0.0 108.389 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -70.21 -61.06 1.92 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.657 -0.652 . . . . 0.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -53.89 -59.22 4.91 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.178 -0.952 . . . . 0.0 111.663 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.18 -44.3 10.76 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.072 -1.017 . . . . 0.0 110.088 -177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 52' ' ' LEU . 24.6 t -70.89 -46.76 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.138 -0.976 . . . . 0.0 109.418 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -44.7 -37.75 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.31 -0.869 . . . . 0.0 109.646 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.487 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 7.8 mtmp? -71.46 -33.8 69.65 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.446 -0.784 . . . . 0.0 109.585 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.1 tp -64.01 -67.9 0.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 t70 67.03 78.76 0.24 Allowed 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.807 0.813 . . . . 0.0 110.572 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.597 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -171.9 149.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.623 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.46 33.97 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.264 -0.897 . . . . 0.0 109.028 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.597 ' H ' ' C ' ' A' ' 54' ' ' VAL . 43.3 tttp -78.07 164.55 24.93 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.313 -0.867 . . . . 0.0 109.146 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.14 91.57 4.34 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.358 -0.838 . . . . 0.0 109.154 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -72.35 -52.05 17.87 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.585 ' C ' ' H ' ' A' ' 61' ' ' HIS . 76.1 p -47.82 -41.84 24.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.62 -0.675 . . . . 0.0 110.008 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -53.99 -4.83 0.06 Allowed 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.25 -0.907 . . . . 0.0 109.091 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.596 ' CG ' ' CE2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -119.12 161.62 20.0 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-O 122.008 0.909 . . . . 0.0 110.129 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . . . -169.99 165.56 9.45 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.494 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -93.35 132.88 37.16 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.603 -1.311 . . . . 0.0 109.637 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -119.73 147.85 44.1 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.618 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -108.29 93.0 4.29 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.112 -0.992 . . . . 0.0 108.551 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.402 ' C ' ' H ' ' A' ' 68' ' ' LYS . 18.2 pt-20 -54.95 -24.12 22.35 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.243 -0.911 . . . . 0.0 110.895 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.52 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 26.0 mmtt -68.58 -8.28 40.31 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 65' ' ' TRP . 16.9 mmtt -133.86 -12.75 2.56 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.9 OUTLIER 52.86 45.77 28.1 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -178.236 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.678 ' HG1' ' H ' ' A' ' 71' ' ' TRP . 5.3 t -113.02 -173.2 2.2 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.423 0.63 . . . . 0.0 109.914 -178.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.678 ' H ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -128.71 98.61 5.05 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 177.082 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.67 82.98 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 O-C-N 120.86 -1.15 . . . . 0.0 110.449 -176.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -117.79 6.84 12.35 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.656 ' HZ3' ' HH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -84.11 68.78 10.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.759 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.414 ' C ' ' O ' ' A' ' 74' ' ' LYS . 28.4 m -40.84 -38.5 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.542 -0.724 . . . . 0.0 110.073 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.541 ' HD1' ' H ' ' A' ' 76' ' ' HIS . 15.4 m80 -58.72 171.45 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.266 -0.896 . . . . 0.0 108.964 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 16.7 m0 56.51 168.17 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.61 0.719 . . . . 0.0 109.737 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.605 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -121.7 -164.48 1.15 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.693 0.758 . . . . 0.0 109.477 -178.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.54 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 4.8 mp -70.41 -59.44 2.86 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -42.82 -51.91 5.25 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.833 0.825 . . . . 0.0 109.755 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.605 ' CG ' ' H ' ' A' ' 78' ' ' THR . 23.0 mmtp -47.16 -54.68 10.05 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.742 0.782 . . . . 0.0 109.362 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.656 ' HH ' ' HZ3' ' A' ' 74' ' ' LYS . 18.5 m-85 -69.21 -43.37 74.26 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.345 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.77 4.23 17.24 Favored Glycine 0 N--CA 1.499 2.843 0 N-CA-C 108.176 -1.97 . . . . 0.0 108.176 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.535 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 45.4 mt -61.55 161.21 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.772 -0.84 . . . . 0.0 109.331 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.535 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -173.15 -166.29 0.34 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.463 -0.773 . . . . 0.0 109.134 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.38 -22.83 64.63 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.409 -0.807 . . . . 0.0 109.968 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -77.41 -11.37 59.83 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.03 113.03 25.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -97.08 118.09 32.72 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.095 -1.003 . . . . 0.0 109.541 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.9 mt -94.63 177.13 6.02 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 4.8 mt-30 -132.89 158.61 42.12 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.329 -1.359 . . . . 0.0 107.329 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.596 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -101.33 109.35 21.18 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 62' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.806 0 O-C-N 120.555 -1.34 . . . . 0.0 109.459 -177.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.534 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -59.96 135.57 57.75 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 120.938 -1.102 . . . . 0.0 110.431 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.58 103.93 13.3 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 178.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.3 t -51.28 127.08 18.58 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.245 1.021 . . . . 0.0 109.727 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.6 -34.79 5.27 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 106.206 -2.758 . . . . 0.0 106.206 -177.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.5 m -105.4 -35.93 7.34 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.416 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.9 mm-40 55.92 56.49 5.96 Favored 'General case' 0 C--N 1.3 -1.557 0 CA-C-O 122.694 1.235 . . . . 0.0 110.079 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp -140.47 123.6 10.14 Favored Pre-proline 0 N--CA 1.496 1.84 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -44.2 134.99 8.66 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.519 1.221 . . . . 0.0 114.743 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.1 mt -94.22 98.29 7.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -99.85 91.17 4.7 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.218 -0.926 . . . . 0.0 111.25 -177.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.77 -95.9 0.15 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 107.584 -2.206 . . . . 0.0 107.584 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.474 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 11.5 mmt180 -112.48 151.31 30.08 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 22.3 p -144.77 126.29 15.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.957 -1.089 . . . . 0.0 111.438 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.97 146.65 5.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.702 ' H ' ' HZ3' ' B' ' 584' ' ' LYS . 7.4 m -118.28 146.78 44.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-O 121.853 0.835 . . . . 0.0 109.158 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.729 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.69 -129.11 0.26 Allowed 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 121.601 0.715 . . . . 0.0 109.441 -178.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 8.4 mtp -65.75 26.07 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.729 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.14 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.95 162.67 22.61 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -104.87 174.56 5.82 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.24 134.0 7.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.417 -1.427 . . . . 0.0 110.24 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.6 m80 -54.04 114.09 5.98 Favored Pre-proline 0 C--N 1.303 -1.443 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 176.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.585 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 37.0 Cg_exo -46.85 -11.45 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.381 1.172 . . . . 0.0 111.218 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' B' ' 569' ' ' HIS . 7.7 mt-10 -95.43 -51.79 4.42 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.046 0.927 . . . . 0.0 110.185 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.536 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.1 m170 -60.21 -3.56 0.64 Allowed 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.982 -1.074 . . . . 0.0 109.859 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' B' ' 571' ' ' GLU . 24.2 t80 -130.31 57.95 1.69 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 17.1 m -94.32 178.04 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-O 121.74 0.781 . . . . 0.0 111.167 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.461 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.93 145.35 30.36 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.169 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -93.56 75.48 4.4 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.794 -1.962 . . . . 0.0 109.239 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -153.46 -64.74 0.15 Allowed 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 102.163 -3.273 . . . . 0.0 102.163 173.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.555 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -114.28 79.43 1.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 111.897 -2.411 . . . . 0.0 104.583 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 9.4 mt -52.86 16.0 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.84 -36.61 15.93 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 119.739 -1.851 . . . . 0.0 112.459 -178.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.585 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.1 tp60 -158.83 140.1 13.13 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 119.562 -1.961 . . . . 0.0 114.822 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.461 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.1 tp -137.94 169.51 17.66 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.435 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.2 m-20 -148.0 130.79 16.06 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.285 -0.884 . . . . 0.0 109.041 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.702 ' HZ3' ' H ' ' B' ' 562' ' ' THR . 0.6 OUTLIER -52.13 -17.2 0.99 Allowed 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.432 -0.793 . . . . 0.0 109.606 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.39 -20.6 51.54 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.24 27.59 4.13 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.85 108.78 19.91 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.589 1.185 . . . . 0.0 109.979 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.507 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.51 168.22 9.64 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.72 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.431 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.95 157.29 40.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.707 -1.246 . . . . 0.0 110.693 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.542 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 3.2 tp60 -155.25 145.96 22.28 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.532 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.0 23.66 0.09 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.09 -1.006 . . . . 0.0 109.97 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 83.43 -6.48 1.17 Allowed 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.828 -0.545 . . . . 0.0 110.869 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -88.0 118.68 69.92 Favored Pre-proline 0 C--N 1.294 -1.816 0 O-C-N 121.279 -0.888 . . . . 0.0 109.559 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.513 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 37.0 Cg_exo -49.41 165.58 0.24 Allowed 'Trans proline' 0 N--CA 1.489 1.209 0 CA-C-N 120.089 1.067 . . . . 0.0 111.808 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.513 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.9 m-85 -170.82 137.66 1.29 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.133 -0.979 . . . . 0.0 110.473 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 28.5 m -70.36 155.63 40.41 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 104.247 -2.501 . . . . 0.0 104.247 174.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.446 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.11 -57.55 12.55 Favored 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 117.563 -1.655 . . . . 0.0 107.001 179.479 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -29.77 1.42 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 89.9 m -80.04 -65.62 0.98 Allowed 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.288 -0.882 . . . . 0.0 108.791 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.578 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.68 -55.86 17.02 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.751 -0.593 . . . . 0.0 110.048 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.578 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -47.06 -39.08 12.22 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.296 -0.877 . . . . 0.0 108.792 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt -67.91 -20.38 65.08 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.57 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 9.6 mt -90.66 -56.84 3.04 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.542 -1.349 . . . . 0.0 111.937 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.542 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 6.2 m-85 -91.61 -29.24 17.02 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.672 -1.268 . . . . 0.0 110.351 -178.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.421 ' O ' ' O ' ' B' ' 601' ' ' LEU . 74.2 m . . . . . 0 N--CA 1.501 2.091 0 CA-C-O 118.062 -0.971 . . . . 0.0 109.448 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.493 2.473 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -85.46 122.83 30.16 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.435 -1.038 . . . . 0.0 109.274 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.417 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -131.79 123.15 27.02 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 179.258 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.14 129.82 35.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.982 . . . . 0.0 108.592 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.481 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.31 131.57 35.07 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -77.85 145.63 36.17 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.444 -0.903 . . . . 0.0 109.296 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.1 t -138.93 113.53 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-O 121.868 0.842 . . . . 0.0 109.909 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.508 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 7.6 m170 -85.83 103.5 14.64 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.525 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -72.44 99.3 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.568 ' C ' ' H ' ' A' ' 27' ' ' LEU . 59.2 p -73.67 -38.3 64.99 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.533 -0.729 . . . . 0.0 109.968 -178.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.41 18.16 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.061 -1.024 . . . . 0.0 108.627 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.568 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.9 mt -152.03 -30.53 0.16 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 84.7 13.61 0.24 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 122.248 -0.282 . . . . 0.0 110.351 -179.784 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -98.42 -178.2 3.94 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 120.954 -1.091 . . . . 0.0 109.952 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.508 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 32.1 m-20 -138.97 117.57 12.16 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 t -117.97 157.3 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-O 121.629 0.728 . . . . 0.0 110.096 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.79 135.33 43.79 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.406 ' CD1' ' NZ ' ' A' ' 51' ' ' LYS . 2.4 mm? -116.51 112.29 21.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.566 -0.709 . . . . 0.0 109.336 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -60.66 103.92 0.3 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 22.1 m -136.28 -170.64 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.972 0.891 . . . . 0.0 110.338 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.417 ' OG1' ' CG ' ' A' ' 38' ' ' GLU . 5.6 p -143.06 176.3 9.2 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.6 45.72 2.94 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.417 ' CG ' ' OG1' ' A' ' 36' ' ' THR . 3.2 pt-20 -144.97 -0.13 0.92 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.295 -1.121 . . . . 0.0 108.605 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.401 HG11 ' H ' ' A' ' 36' ' ' THR . 1.7 m -87.89 134.11 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 121.006 -1.059 . . . . 0.0 109.81 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 m-70 -69.61 139.41 53.62 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 121.1 -1.0 . . . . 0.0 108.823 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.469 ' C ' ' H ' ' A' ' 43' ' ' GLY . 14.7 mt -47.31 -58.55 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.0 109.322 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.51 -13.19 5.38 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 108.219 -1.952 . . . . 0.0 108.219 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.84 -24.95 73.02 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 6.4 t -83.67 -38.5 14.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.476 ' O ' ' CG2' ' A' ' 49' ' ' VAL . 31.6 mtm -48.41 -37.39 16.88 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.1 tp -73.57 -61.27 1.89 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.738 -0.602 . . . . 0.0 110.788 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -53.49 -61.27 2.41 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.214 -0.929 . . . . 0.0 110.889 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.6 tp -49.74 -35.06 20.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.277 -0.889 . . . . 0.0 109.416 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.476 ' CG2' ' O ' ' A' ' 45' ' ' MET . 9.2 t -73.02 -48.6 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.33 -0.856 . . . . 0.0 108.767 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -44.71 -37.44 3.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.536 -0.727 . . . . 0.0 109.559 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.406 ' NZ ' ' CD1' ' A' ' 33' ' ' LEU . 55.5 mttp -71.16 -34.75 71.27 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.449 -0.782 . . . . 0.0 110.355 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -63.24 1.33 Allowed 'General case' 0 C--N 1.306 -1.283 0 O-C-N 120.953 -1.092 . . . . 0.0 109.062 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 t70 69.54 78.3 0.21 Allowed 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.884 0.85 . . . . 0.0 109.895 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.586 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -171.51 147.42 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 C-N-CA 119.951 -0.699 . . . . 0.0 110.391 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -68.96 35.37 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.444 -0.785 . . . . 0.0 108.959 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.586 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.4 ttmm -78.34 154.64 30.65 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.12 -0.988 . . . . 0.0 108.817 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.22 97.75 0.75 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 108.767 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.541 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 45.7 m0 -80.45 -45.19 18.01 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.809 -0.557 . . . . 0.0 110.095 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.2 t -56.39 -56.61 19.03 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.995 -1.066 . . . . 0.0 110.399 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -49.83 -24.63 2.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.16 -0.963 . . . . 0.0 108.881 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.541 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -73.36 148.17 43.66 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.961 0.886 . . . . 0.0 109.731 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -160.68 152.6 19.94 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.566 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -94.79 143.06 26.76 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.141 -0.975 . . . . 0.0 109.716 -179.088 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.531 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.23 137.4 52.88 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.5 t90 -95.77 89.78 5.42 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.589 -0.694 . . . . 0.0 109.425 -179.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.471 ' C ' ' N ' ' A' ' 68' ' ' LYS . 14.4 pt-20 -53.98 -23.78 14.39 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.176 -0.952 . . . . 0.0 110.298 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.477 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.5 mmtp -63.91 -10.8 22.95 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.471 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -134.95 -12.3 2.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.212 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.6 44.95 29.07 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -110.03 -174.15 2.42 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.515 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.92 99.6 5.58 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 177.529 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.6 mt -59.88 83.75 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.053 0 CA-C-O 122.361 1.077 . . . . 0.0 110.662 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.5 6.69 10.07 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.133 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.465 ' HZ1' ' HZ1' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.73 74.04 5.27 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.21 -0.931 . . . . 0.0 109.542 -179.472 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.416 ' C ' ' H ' ' A' ' 77' ' ' TRP . 11.8 p -75.93 -18.55 59.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.285 -0.884 . . . . 0.0 109.882 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -76.76 36.54 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.117 -0.989 . . . . 0.0 110.25 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.416 ' H ' ' C ' ' A' ' 75' ' ' THR . 0.0 OUTLIER -175.57 -143.81 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.484 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -152.96 149.53 28.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.851 -1.781 . . . . 0.0 109.506 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 82' ' ' TYR . 1.3 pt? -40.2 -48.63 2.59 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.196 -0.94 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.436 ' H ' HD21 ' A' ' 79' ' ' LEU . 18.0 t70 -47.23 -33.46 5.47 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.171 -0.956 . . . . 0.0 109.574 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.535 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.73 -31.08 70.77 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.535 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -79.02 -50.93 10.3 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 178.629 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.1 9.39 6.13 Favored Glycine 0 N--CA 1.509 3.562 0 N-CA-C 108.898 -1.681 . . . . 0.0 108.898 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.546 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 56.4 mt -60.63 161.35 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.546 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.47 -168.68 1.57 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.255 -0.903 . . . . 0.0 109.074 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.34 -23.04 65.58 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.284 -0.885 . . . . 0.0 110.157 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -2.24 56.99 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.196 -0.94 . . . . 0.0 108.908 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.481 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.37 113.03 25.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.527 -0.733 . . . . 0.0 109.641 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp -98.32 115.55 28.67 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.995 -1.066 . . . . 0.0 109.741 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.7 mt -95.38 176.11 6.32 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -133.58 156.63 47.48 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.538 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 2.2 t80 -115.21 126.4 54.51 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 O-C-N 120.992 -1.068 . . . . 0.0 110.274 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.536 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -58.15 135.67 57.1 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.893 -1.129 . . . . 0.0 110.375 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -84.01 104.12 13.82 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 178.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.52 125.4 11.24 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 122.077 0.941 . . . . 0.0 109.695 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -33.86 5.83 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 106.569 -2.612 . . . . 0.0 106.569 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.1 m -106.3 -35.52 7.13 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.408 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 54.97 56.65 6.38 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.793 1.283 . . . . 0.0 109.937 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -140.66 123.77 10.04 Favored Pre-proline 0 C--N 1.295 -1.78 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -44.1 134.03 8.57 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 CA-C-N 120.461 1.2 . . . . 0.0 114.674 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.536 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.2 mt -92.65 98.37 8.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' B' ' 557' ' ' THR . 6.9 p -99.71 91.16 4.73 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.301 -177.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.1 -96.01 0.15 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.433 -2.267 . . . . 0.0 107.433 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -113.2 150.9 31.66 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.53 126.48 15.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.0 -1.062 . . . . 0.0 111.384 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.3 mt -90.57 146.21 6.47 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.3 m -121.21 146.4 46.84 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-O 121.982 0.896 . . . . 0.0 108.968 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.713 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -124.56 -127.9 0.25 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-O 122.092 0.949 . . . . 0.0 108.783 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 0.0 OUTLIER -65.51 28.1 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.713 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 103.43 -8.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 149.64 26.75 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -95.69 174.86 6.77 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -160.36 134.02 6.99 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 118.289 -1.365 . . . . 0.0 110.077 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.59 ' O ' ' N ' ' B' ' 571' ' ' GLU . 6.0 m80 -55.65 115.84 10.49 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 177.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 53.0 Cg_exo -45.32 -9.5 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.43 0 CA-C-N 120.298 1.142 . . . . 0.0 112.141 -178.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.59 ' N ' ' O ' ' B' ' 569' ' ' HIS . 7.3 mt-10 -102.03 -52.55 3.14 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 122.059 0.933 . . . . 0.0 109.978 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.515 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 16.7 m170 -56.88 -3.96 0.14 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.862 -1.149 . . . . 0.0 109.992 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.52 ' H ' ' C ' ' B' ' 571' ' ' GLU . 20.6 t80 -126.6 55.6 1.52 Allowed 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . 0.419 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 16.1 m -94.25 177.68 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-O 121.711 0.767 . . . . 0.0 110.818 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.465 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.62 145.06 33.27 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.45 74.21 3.28 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 116.621 -2.031 . . . . 0.0 109.03 178.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.34 -47.45 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 102.87 -3.011 . . . . 0.0 102.87 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.572 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.6 p -132.95 81.28 1.93 Allowed 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.282 -2.236 . . . . 0.0 104.975 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . 0.63 ' CD1' ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.67 15.5 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -176.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.09 -36.95 17.83 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 119.474 -2.016 . . . . 0.0 112.69 -178.302 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -160.36 140.1 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 119.416 -2.052 . . . . 0.0 114.969 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.465 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.6 tp -139.53 169.3 18.0 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.455 ' O ' ' N ' ' B' ' 587' ' ' PHE . 71.8 m-20 -145.62 130.55 18.23 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.159 -0.963 . . . . 0.0 108.864 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -52.44 -21.38 3.62 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.433 -0.792 . . . . 0.0 109.577 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.2 -16.35 60.94 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.6 p -134.66 26.27 3.7 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.906 -0.761 . . . . 0.0 108.971 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -88.64 109.69 20.32 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 122.443 1.116 . . . . 0.0 109.484 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.46 162.55 12.96 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.2 tt0 -153.83 156.89 38.48 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.558 1.17 . . . . 0.0 111.026 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.498 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 4.4 tt0 -156.46 141.52 17.25 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 105.985 -1.857 . . . . 0.0 105.985 178.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.706 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.95 25.81 3.32 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 120.846 -1.159 . . . . 0.0 109.288 178.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.8 m-20 79.85 -7.7 1.64 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.708 -0.62 . . . . 0.0 111.365 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . 0.458 ' O ' ' CE2' ' B' ' 595' ' ' TYR . 15.9 mttt -86.99 115.69 63.47 Favored Pre-proline 0 C--N 1.295 -1.791 0 O-C-N 121.153 -0.967 . . . . 0.0 110.282 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.597 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 32.7 Cg_exo -53.31 160.53 4.7 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 CA-C-N 119.969 1.025 . . . . 0.0 111.979 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.597 ' CD1' ' O ' ' B' ' 594' ' ' PRO . 51.8 m-85 -168.19 135.59 2.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.623 -0.673 . . . . 0.0 110.167 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.7 m -65.53 154.97 37.12 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 175.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.451 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.73 -57.35 13.06 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 178.628 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.09 -29.18 1.41 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 17.8 m -81.81 -61.18 1.99 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.537 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -56.59 -52.26 65.51 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.207 0.527 . . . . 0.0 110.133 -179.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.537 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -50.95 -43.33 60.26 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.055 -1.028 . . . . 0.0 109.072 -178.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.59 -21.2 16.34 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.558 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 1.7 mt -94.24 -56.41 2.85 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.86 -1.15 . . . . 0.0 111.111 -178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.503 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 23.9 m-85 -94.91 5.5 51.73 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.934 -1.104 . . . . 0.0 110.11 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.503 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 20.0 m . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.958 -1.089 . . . . 0.0 109.41 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.9 p -91.09 122.84 34.07 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.714 -0.874 . . . . 0.0 109.987 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -129.66 121.49 27.09 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.84 128.93 35.51 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.247 -0.908 . . . . 0.0 108.875 -179.664 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.491 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.67 132.3 34.89 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.411 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.56 145.71 34.67 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.726 -0.79 . . . . 0.0 110.22 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.9 t -135.4 103.97 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 CA-C-O 121.586 0.707 . . . . 0.0 109.49 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -78.05 104.48 8.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 178.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.547 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.4 t -69.83 108.77 2.21 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.003 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.537 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.8 p -77.42 162.86 26.89 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.4 t0 73.16 -43.74 0.57 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.4 mt -92.73 -36.67 12.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 78.53 18.17 1.02 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -93.04 -178.94 4.95 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.834 -1.166 . . . . 0.0 109.436 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -137.93 113.87 9.9 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.2 t -110.58 152.37 12.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 CA-C-O 121.59 0.71 . . . . 0.0 109.45 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.82 130.52 38.05 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -114.22 112.98 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.687 -0.633 . . . . 0.0 109.39 -179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -59.79 105.63 0.4 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 m -135.37 -170.39 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 CA-C-O 121.812 0.815 . . . . 0.0 110.13 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.408 ' H ' HG12 ' A' ' 39' ' ' VAL . 8.8 p -142.12 175.03 10.06 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.61 47.87 3.1 Favored Glycine 0 N--CA 1.483 1.799 0 N-CA-C 109.068 -1.613 . . . . 0.0 109.068 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.417 ' O ' ' OE2' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -147.38 -3.57 0.55 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.482 -1.01 . . . . 0.0 108.998 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.408 HG12 ' H ' ' A' ' 36' ' ' THR . 1.3 m -86.55 128.28 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.062 -1.024 . . . . 0.0 110.081 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 43' ' ' GLY . 5.6 m-70 -63.36 149.76 45.04 Favored 'General case' 0 C--N 1.29 -1.992 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.985 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.46 ' C ' ' H ' ' A' ' 43' ' ' GLY . 25.4 mt -49.64 -54.69 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.972 -1.08 . . . . 0.0 108.523 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.06 -12.2 5.34 Favored Glycine 0 C--N 1.299 -1.526 0 N-CA-C 108.139 -1.984 . . . . 0.0 108.139 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -65.69 -27.46 72.68 Favored Glycine 0 N--CA 1.482 1.703 0 N-CA-C 107.357 -2.297 . . . . 0.0 107.357 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -83.68 -44.81 18.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 34.1 mtm -46.96 -37.16 8.61 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -67.48 -65.67 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.347 0.594 . . . . 0.0 110.57 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -53.36 -53.38 51.9 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.391 -0.818 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -45.54 -59.24 2.83 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.723 -1.236 . . . . 0.0 109.687 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 85.1 t -54.25 -51.45 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.849 -1.157 . . . . 0.0 109.749 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -44.79 -40.22 5.92 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.355 -0.841 . . . . 0.0 110.145 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -68.21 -57.57 5.81 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.157 -0.964 . . . . 0.0 111.275 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.406 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.9 OUTLIER -62.11 -66.33 0.56 Allowed 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.82 -1.175 . . . . 0.0 109.014 -179.162 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.0 t70 72.38 82.54 0.14 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.928 0.871 . . . . 0.0 109.914 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.559 ' C ' ' H ' ' A' ' 56' ' ' LYS . 1.7 p -167.05 150.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.146 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.815 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -68.36 35.02 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.499 -0.75 . . . . 0.0 110.139 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.559 ' H ' ' C ' ' A' ' 54' ' ' VAL . 3.2 ttpm? -81.78 155.56 25.38 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.082 -1.011 . . . . 0.0 109.512 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -49.66 112.43 0.65 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.274 -0.891 . . . . 0.0 109.649 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 30.1 m95 -125.09 -30.31 3.22 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.562 -0.711 . . . . 0.0 110.045 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -56.6 13.72 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 120.914 -1.116 . . . . 0.0 110.797 -178.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -69.4 -4.0 16.62 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.106 -0.997 . . . . 0.0 110.396 -178.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.99 153.62 40.85 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.133 0.968 . . . . 0.0 110.676 -179.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -167.87 155.52 8.57 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.573 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.6 mm? -93.73 148.42 22.13 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.893 -1.13 . . . . 0.0 109.708 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.524 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.48 148.68 50.31 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.023 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.548 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -107.96 91.45 3.65 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.073 -1.017 . . . . 0.0 108.43 -178.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -55.23 -22.53 18.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.122 -0.986 . . . . 0.0 111.203 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.482 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -65.18 -18.61 65.45 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.177 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.408 ' N ' ' O ' ' A' ' 65' ' ' TRP . 19.3 mmtt -123.95 -13.07 7.43 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.428 -178.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.548 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.54 46.29 26.41 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 -177.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 t -113.49 -172.5 2.08 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.473 0.654 . . . . 0.0 109.851 -178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.475 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.64 104.38 8.35 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 177.672 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.2 mt -62.86 83.95 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.256 0 O-C-N 120.474 -1.391 . . . . 0.0 110.995 -176.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.475 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -119.02 6.73 11.32 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.509 ' C ' ' H ' ' A' ' 76' ' ' HIS . 5.9 mmpt? -76.36 32.76 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.469 ' H ' ' C ' ' A' ' 73' ' ' LEU . 7.2 m -50.52 -10.08 0.06 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.102 -0.999 . . . . 0.0 109.661 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.509 ' H ' ' C ' ' A' ' 74' ' ' LYS . 5.0 t60 -53.47 -65.93 0.48 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.233 -0.917 . . . . 0.0 109.265 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -85.73 -143.16 0.1 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.572 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.576 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -130.47 169.67 15.22 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.535 ' H ' ' CD2' ' A' ' 79' ' ' LEU . 1.5 pt? -60.19 -50.34 74.04 Favored 'General case' 0 C--N 1.287 -2.142 0 O-C-N 121.327 -0.858 . . . . 0.0 109.952 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.422 ' H ' HD21 ' A' ' 79' ' ' LEU . 19.9 t70 -43.89 -35.89 2.17 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-O 122.19 0.995 . . . . 0.0 109.124 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.576 ' CG ' ' H ' ' A' ' 78' ' ' THR . 44.5 mmtt -65.12 -51.35 61.76 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -44.89 95.71 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 115.14 37.29 1.13 Allowed Glycine 0 N--CA 1.511 3.695 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.543 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 56.8 mt -92.96 161.98 2.46 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -165.01 -166.03 0.97 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.259 -0.9 . . . . 0.0 109.465 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.92 -22.08 64.18 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.461 -0.774 . . . . 0.0 109.784 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -5.48 58.15 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.31 -0.869 . . . . 0.0 108.779 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.33 112.44 24.62 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.537 -0.727 . . . . 0.0 109.196 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -97.2 115.4 27.52 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.996 -1.065 . . . . 0.0 109.61 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 mt -93.42 176.18 6.48 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.524 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 5.0 mt-30 -135.19 157.15 47.66 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.476 ' CD2' ' C ' ' A' ' 92' ' ' PHE . 0.6 OUTLIER -105.76 131.86 52.6 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.365 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.052 0 O-C-N 120.95 -1.094 . . . . 0.0 109.196 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.6 m . . . . . 0 N--CA 1.488 1.447 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.68 134.68 57.32 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.808 -1.183 . . . . 0.0 110.216 -178.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.37 104.03 13.21 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 178.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.6 t -50.88 127.03 17.55 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 122.174 0.988 . . . . 0.0 109.668 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.59 -34.65 5.35 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 106.081 -2.807 . . . . 0.0 106.081 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -105.58 -35.94 7.27 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.2 mm-40 55.07 56.39 6.61 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.73 1.252 . . . . 0.0 109.914 -178.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -140.57 123.7 10.09 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -44.31 134.83 9.0 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 CA-C-N 120.446 1.195 . . . . 0.0 114.633 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.1 mt -93.9 98.41 8.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.414 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -99.54 91.26 4.82 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.258 -0.901 . . . . 0.0 111.208 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.46 -96.12 0.15 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 107.396 -2.282 . . . . 0.0 107.396 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.472 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.15 151.15 31.23 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.5 p -144.55 126.28 15.2 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.462 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.85 146.62 5.98 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.502 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 8.3 m -117.93 146.77 43.73 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.743 0.782 . . . . 0.0 109.041 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.737 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.51 -129.36 0.26 Allowed 'General case' 0 C--N 1.294 -1.814 0 CA-C-O 121.598 0.713 . . . . 0.0 109.228 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 4.0 mtt -65.84 26.27 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.737 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.33 -9.11 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -81.75 162.58 22.89 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.63 174.97 5.65 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.213 -1.402 . . . . 0.0 107.213 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.99 133.7 6.22 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 117.986 -1.486 . . . . 0.0 110.257 -178.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.594 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.7 m80 -54.32 115.17 7.88 Favored Pre-proline 0 C--N 1.304 -1.393 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 177.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.532 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.1 Cg_exo -45.38 -8.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 CA-C-N 120.278 1.135 . . . . 0.0 112.412 -178.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.594 ' N ' ' O ' ' B' ' 569' ' ' HIS . 8.5 mt-10 -104.11 -53.12 2.8 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 122.154 0.978 . . . . 0.0 109.757 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.516 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.6 m170 -54.73 -5.55 0.09 Allowed 'General case' 0 C--N 1.293 -1.86 0 O-C-N 120.431 -1.418 . . . . 0.0 109.734 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.533 ' H ' ' C ' ' B' ' 571' ' ' GLU . 15.9 t80 -125.45 53.46 1.54 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 12.5 m -93.5 176.75 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.622 -0.674 . . . . 0.0 109.94 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.443 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.12 142.03 36.77 Favored 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.14 74.83 4.04 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 116.58 -2.048 . . . . 0.0 109.774 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.96 -57.87 0.15 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 101.655 -3.461 . . . . 0.0 101.655 172.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.552 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.1 p -122.39 78.48 1.51 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 111.922 -2.399 . . . . 0.0 104.738 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.8 mp -52.01 16.3 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -176.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.552 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.37 -37.42 21.56 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 119.476 -2.015 . . . . 0.0 112.328 -178.406 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.532 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -161.32 143.39 11.97 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 119.474 -2.016 . . . . 0.0 114.199 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.443 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.7 tp -138.95 170.69 15.53 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.452 ' O ' ' N ' ' B' ' 587' ' ' PHE . 69.0 m-20 -146.56 137.87 24.37 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.263 -0.898 . . . . 0.0 109.394 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.502 ' CE ' ' H ' ' B' ' 562' ' ' THR . 6.1 ptpp? -55.29 -22.43 18.67 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.582 0.706 . . . . 0.0 110.09 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.05 -17.06 59.96 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -131.18 23.56 4.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.967 -0.725 . . . . 0.0 109.344 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.538 ' O ' ' CG ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.7 113.02 25.0 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 122.235 1.017 . . . . 0.0 109.341 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -107.25 165.0 11.7 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 179.022 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.45 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.4 tt0 -152.13 156.99 40.93 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.719 1.247 . . . . 0.0 110.47 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.642 ' NE2' ' CE2' ' B' ' 600' ' ' PHE . 0.0 OUTLIER -160.96 146.55 14.44 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.589 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.37 22.82 0.5 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.749 -1.219 . . . . 0.0 109.425 -178.718 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.0 m-20 79.91 -6.38 1.77 Allowed 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.636 -0.665 . . . . 0.0 111.448 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . 0.52 ' O ' ' CE1' ' B' ' 595' ' ' TYR . 33.3 mttm -88.96 115.89 64.8 Favored Pre-proline 0 C--N 1.294 -1.832 0 O-C-N 121.064 -1.022 . . . . 0.0 110.121 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.562 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.0 Cg_exo -51.54 163.14 1.23 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 119.998 1.035 . . . . 0.0 112.369 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.562 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 66.4 m-85 -169.78 142.31 2.44 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.449 -0.782 . . . . 0.0 110.099 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 5.9 m -67.42 154.86 40.38 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.43 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.07 -58.01 10.54 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -48.29 -24.96 1.35 Allowed 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.629 -0.669 . . . . 0.0 110.025 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 1.4 m -77.08 -65.69 0.92 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.23 -0.919 . . . . 0.0 110.432 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.642 ' CE2' ' NE2' ' B' ' 590' ' ' GLN . 2.1 t80 -70.81 -40.49 72.45 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.848 -1.157 . . . . 0.0 111.261 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.472 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -52.11 -42.94 63.68 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -54.84 -25.33 27.83 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . 0.5 ' N ' ' O ' ' B' ' 600' ' ' PHE . 11.6 mt -95.29 -57.95 2.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.477 -0.764 . . . . 0.0 111.652 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.494 ' CD1' ' CE2' ' B' ' 600' ' ' PHE . 13.0 m-85 -100.81 32.62 3.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.97 -1.082 . . . . 0.0 110.268 -179.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 109.698 179.526 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.123 0 N-CA-C 108.506 -1.838 . . . . 0.0 108.506 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.459 ' O ' ' CG2' ' A' ' 17' ' ' THR . 4.8 t -103.57 122.43 44.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.752 -0.852 . . . . 0.0 109.736 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.512 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -119.2 128.19 53.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.513 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.11 136.19 36.48 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.375 -0.828 . . . . 0.0 110.074 -179.392 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.492 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.45 132.78 34.16 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.319 -1.364 . . . . 0.0 107.319 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.96 145.49 36.03 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.788 -1.195 . . . . 0.0 108.234 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.9 t -140.46 115.96 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.719 0.771 . . . . 0.0 110.303 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -88.6 103.69 16.15 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.574 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -68.96 108.31 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.567 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.3 p -75.62 -55.94 5.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.274 -0.891 . . . . 0.0 110.566 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.546 ' CB ' ' NE2' ' A' ' 61' ' ' HIS . 25.6 t0 -58.24 1.06 0.06 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.039 -1.038 . . . . 0.0 109.824 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.567 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.6 mt -134.51 -25.09 1.52 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.341 -0.849 . . . . 0.0 109.433 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.14 14.26 2.53 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.923 -0.486 . . . . 0.0 110.199 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -94.04 -178.07 4.52 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.871 -1.143 . . . . 0.0 109.836 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -136.76 119.12 15.71 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.1 t -122.54 157.8 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-O 121.658 0.742 . . . . 0.0 110.065 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.07 133.42 42.97 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -115.27 113.12 23.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.618 -0.676 . . . . 0.0 110.151 -179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.423 ' CA ' ' HE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -58.52 114.05 2.29 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.001 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.4 m -140.88 -170.2 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-O 121.967 0.889 . . . . 0.0 110.498 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.5 p -144.18 175.3 10.17 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.92 43.79 3.03 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -145.25 5.14 1.09 Allowed 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.6 m -89.97 136.81 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.015 -1.053 . . . . 0.0 109.993 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m-70 -75.31 141.87 43.33 Favored 'General case' 0 C--N 1.292 -1.924 0 O-C-N 120.96 -1.088 . . . . 0.0 108.232 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.489 ' C ' ' H ' ' A' ' 43' ' ' GLY . 32.3 mt -47.07 -57.99 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.001 -1.062 . . . . 0.0 109.654 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.05 -13.49 3.56 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 108.143 -1.983 . . . . 0.0 108.143 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.6 -28.89 64.52 Favored Glycine 0 N--CA 1.485 1.944 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.8 t -83.74 -39.01 14.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.7 mtm -46.47 -39.88 11.43 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.33 -58.1 3.43 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.52 -0.737 . . . . 0.0 110.535 -178.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 39.0 mttm -47.89 -59.34 3.41 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.775 -1.203 . . . . 0.0 109.893 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 36.0 tp -45.75 -38.28 6.85 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.337 -0.852 . . . . 0.0 109.391 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 81.4 t -78.37 -42.39 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.155 -0.966 . . . . 0.0 109.403 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.429 ' O ' ' OD1' ' A' ' 53' ' ' ASP . 39.5 mm-40 -46.54 -39.92 11.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.272 -0.892 . . . . 0.0 109.276 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.485 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.0 mtmp? -74.78 -34.01 62.37 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.52 -69.02 0.51 Allowed 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 50' ' ' GLU . 91.2 m-20 52.8 68.09 0.89 Allowed 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.17 0.509 . . . . 0.0 109.725 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.537 ' O ' ' N ' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -136.42 32.06 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 122.0 0.905 . . . . 0.0 109.927 -178.775 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.1 tptt 41.66 19.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.732 -0.605 . . . . 0.0 110.647 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.537 ' N ' ' O ' ' A' ' 54' ' ' VAL . 28.3 ttmt -75.65 151.37 37.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.826 -1.171 . . . . 0.0 107.939 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 57' ' ' ASP . 0.7 OUTLIER -53.59 89.78 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.405 -0.809 . . . . 0.0 108.925 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.528 ' N ' ' O ' ' A' ' 56' ' ' LYS . 10.7 m0 -78.3 -43.47 27.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.537 ' C ' ' H ' ' A' ' 61' ' ' HIS . 32.2 t -54.2 -48.69 70.72 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.609 -0.682 . . . . 0.0 109.249 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -59.59 -1.41 0.24 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.387 -0.82 . . . . 0.0 109.16 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.546 ' NE2' ' CB ' ' A' ' 26' ' ' ASP . 14.9 m80 -123.18 147.93 46.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.619 -0.676 . . . . 0.0 109.477 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.511 ' H ' ' C ' ' A' ' 93' ' ' THR . . . -156.38 179.35 9.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.384 -0.822 . . . . 0.0 108.828 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.528 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 2.9 mm? -94.92 140.43 29.95 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.02 -1.05 . . . . 0.0 110.502 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.495 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -134.67 146.6 49.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.534 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.5 t90 -105.82 91.34 3.7 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.938 -1.101 . . . . 0.0 108.751 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 9.7 pt-20 -55.92 -22.52 26.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.968 . . . . 0.0 110.811 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -64.9 -18.09 64.9 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 178.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -125.45 -11.37 6.84 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.303 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.534 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.2 mpp_? 53.34 47.38 24.34 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 -178.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -115.14 -170.75 1.82 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.45 0.643 . . . . 0.0 110.033 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -124.28 99.83 6.41 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 177.081 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.0 86.5 0.01 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.676 -1.265 . . . . 0.0 110.895 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.541 ' C ' ' H ' ' A' ' 75' ' ' THR . 3.1 pp -121.35 4.33 10.26 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -69.82 35.09 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.062 -1.024 . . . . 0.0 109.306 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.541 ' H ' ' C ' ' A' ' 73' ' ' LEU . 21.8 m -51.73 -7.18 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.684 -1.26 . . . . 0.0 109.849 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.541 ' H ' ' C ' ' A' ' 74' ' ' LYS . 1.1 t60 -50.31 -73.14 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.183 -0.948 . . . . 0.0 110.2 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -90.64 -112.43 0.08 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.083 -1.011 . . . . 0.0 109.961 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.83 -163.39 1.7 Allowed 'General case' 0 N--CA 1.504 2.233 0 O-C-N 119.563 -1.961 . . . . 0.0 111.445 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.528 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.8 mp -70.51 -57.27 4.94 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -42.68 -45.68 4.79 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.127 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.489 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.489 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -83.18 -47.94 11.04 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.38 7.17 12.56 Favored Glycine 0 N--CA 1.501 3.012 0 N-CA-C 108.547 -1.821 . . . . 0.0 108.547 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.515 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 36.9 mt -61.15 160.49 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -154.15 -164.42 1.85 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 108.986 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -75.25 -17.28 60.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.348 -0.845 . . . . 0.0 109.772 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.06 3.85 50.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.492 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.02 113.34 25.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.284 -0.885 . . . . 0.0 108.981 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -96.03 123.63 39.72 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.001 -1.062 . . . . 0.0 109.994 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.6 mt -106.46 177.94 4.71 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.771 0.795 . . . . 0.0 109.123 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.495 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.0 mt-30 -131.87 165.36 24.04 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -117.05 91.34 3.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.511 ' C ' ' H ' ' A' ' 62' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.67 135.58 57.68 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 120.949 -1.094 . . . . 0.0 110.259 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.38 103.5 12.79 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.3 t -50.22 126.1 13.99 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-O 122.153 0.978 . . . . 0.0 109.628 -177.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.17 5.6 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 106.304 -2.718 . . . . 0.0 106.304 -177.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.1 m -105.94 -35.82 7.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.427 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.0 mm-40 55.16 56.22 6.74 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 122.658 1.218 . . . . 0.0 110.004 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp -140.79 124.21 10.13 Favored Pre-proline 0 C--N 1.293 -1.853 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -44.38 136.05 8.69 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.447 1.195 . . . . 0.0 114.612 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.0 mt -95.37 98.26 7.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.41 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -100.11 90.72 4.47 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.259 -0.901 . . . . 0.0 111.169 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.01 -95.87 0.15 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.405 -2.278 . . . . 0.0 107.405 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.458 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.5 mmt180 -113.15 149.52 33.48 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.34 126.36 15.47 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.984 -1.073 . . . . 0.0 111.455 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.9 mt -91.14 146.86 5.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.682 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.9 m -117.28 146.96 42.98 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.766 0.793 . . . . 0.0 109.131 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.743 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.67 -129.3 0.26 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.551 0.691 . . . . 0.0 109.401 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.55 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.2 mtt -65.78 26.26 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.743 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.2 -8.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 -178.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -81.42 164.45 22.06 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -106.94 174.5 5.86 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.88 137.57 8.72 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.104 -1.438 . . . . 0.0 110.005 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.603 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.3 m80 -57.11 116.01 12.23 Favored Pre-proline 0 C--N 1.3 -1.574 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 177.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.55 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.9 Cg_exo -43.9 -9.38 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.391 0 CA-C-N 120.129 1.082 . . . . 0.0 112.755 -178.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.603 ' N ' ' O ' ' B' ' 569' ' ' HIS . 6.9 mt-10 -105.26 -52.85 2.76 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.197 -0.939 . . . . 0.0 110.037 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.508 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 13.3 m170 -55.79 -4.97 0.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.822 -1.174 . . . . 0.0 109.75 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.522 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.2 t80 -122.26 52.15 1.32 Allowed 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . 0.408 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 18.7 m -92.53 177.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.396 0 CA-C-O 121.58 0.705 . . . . 0.0 109.218 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -79.74 145.83 32.68 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.476 -0.765 . . . . 0.0 109.088 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . 0.464 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -93.55 77.16 4.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 117.019 -1.873 . . . . 0.0 108.809 178.023 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -151.28 -45.96 0.11 Allowed 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 101.802 -3.407 . . . . 0.0 101.802 174.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.8 OUTLIER -126.83 154.98 43.61 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 111.677 -2.511 . . . . 0.0 105.314 177.559 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . 0.648 ' H ' ' CD2' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -104.74 14.32 29.89 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.659 -1.276 . . . . 0.0 111.281 -178.288 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.424 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -100.28 -39.25 8.12 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-N 120.909 1.686 . . . . 0.0 115.502 -176.181 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.57 142.44 9.48 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 122.29 2.314 . . . . 0.0 115.846 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.439 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 24.2 tp -136.91 169.75 17.24 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 174.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.446 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.0 m-20 -147.32 129.66 15.73 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.992 -1.067 . . . . 0.0 109.299 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.682 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 4.0 ptpp? -51.17 -17.72 0.73 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.539 -0.726 . . . . 0.0 109.753 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.29 -20.81 51.28 Favored Glycine 0 N--CA 1.487 2.072 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 586' ' ' THR . . . . . 0.428 ' N ' ' O ' ' B' ' 583' ' ' ASN . 2.3 p -133.88 28.11 3.89 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.582 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.6 OUTLIER -89.64 106.98 18.82 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.736 1.255 . . . . 0.0 109.836 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.72 167.71 10.61 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 179.486 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -152.08 157.27 41.39 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 122.634 1.207 . . . . 0.0 110.721 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.546 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 2.1 tp60 -154.87 146.12 22.88 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.497 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.24 23.89 0.13 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.969 -1.082 . . . . 0.0 110.111 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.483 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.5 m-20 81.66 -4.9 1.57 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.598 -0.689 . . . . 0.0 110.809 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -89.15 121.69 69.33 Favored Pre-proline 0 C--N 1.294 -1.827 0 O-C-N 121.296 -0.878 . . . . 0.0 109.457 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.48 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.7 Cg_exo -48.71 164.82 0.2 Allowed 'Trans proline' 0 N--CA 1.489 1.227 0 CA-C-N 119.945 1.016 . . . . 0.0 111.809 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.2 m-85 -170.51 141.48 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.626 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 20.6 m -76.16 155.74 34.32 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 104.455 -2.424 . . . . 0.0 104.455 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.453 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.77 -57.82 11.08 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 117.293 -1.763 . . . . 0.0 106.383 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.03 -29.09 1.34 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.503 -0.748 . . . . 0.0 109.359 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.8 m -80.89 -64.82 1.11 Allowed 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -53.35 -53.37 52.08 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.672 -0.642 . . . . 0.0 109.988 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.576 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -48.52 -42.34 32.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.092 -1.005 . . . . 0.0 108.776 -179.167 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 26.3 tptt -61.36 -20.4 62.95 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.38 -0.825 . . . . 0.0 110.26 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 7.7 mt -91.68 -56.29 3.16 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.69 -1.257 . . . . 0.0 110.409 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.546 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 3.8 m-85 -93.16 9.3 36.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.991 -1.068 . . . . 0.0 109.618 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 12.0 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.302 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.529 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.488 2.147 0 N-CA-C 107.558 -2.217 . . . . 0.0 107.558 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 p -75.66 121.92 23.2 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.006 0.908 . . . . 0.0 110.726 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -141.35 124.07 16.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 178.676 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.87 130.97 40.98 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.59 -1.319 . . . . 0.0 109.872 -179.173 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.478 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.55 130.68 34.71 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 179.107 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.78 146.15 33.95 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.331 -0.855 . . . . 0.0 109.818 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.493 ' CG1' ' N ' ' A' ' 23' ' ' HIS . 25.1 t -132.4 156.82 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-O 122.388 1.09 . . . . 0.0 110.042 178.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.538 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 15.7 m80 -128.42 98.91 5.21 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 104.195 -2.521 . . . . 0.0 104.195 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.56 ' O ' ' N ' ' A' ' 28' ' ' ASN . 9.0 t -73.15 94.35 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 C-N-CA 119.026 -1.07 . . . . 0.0 109.149 -178.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.528 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -64.99 169.08 5.64 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.742 -1.206 . . . . 0.0 107.742 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 0.9 OUTLIER 73.01 -45.52 0.62 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.528 ' H ' ' C ' ' A' ' 25' ' ' THR . 9.1 tp -92.15 -32.62 15.05 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.56 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 73.05 9.91 5.32 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.447 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.433 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 60.0 mtp180 -87.03 -179.79 6.54 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 120.53 -1.356 . . . . 0.0 108.947 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.538 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 1.0 OUTLIER -143.04 123.05 13.57 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.875 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.6 t -127.69 158.64 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 CA-C-O 121.415 0.626 . . . . 0.0 110.771 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.34 139.95 53.52 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -119.73 113.33 20.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.536 -0.727 . . . . 0.0 109.89 -178.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -60.41 104.35 0.32 Allowed 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.5 m -129.17 -169.03 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 122.01 0.909 . . . . 0.0 110.566 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.407 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.1 p -143.39 166.32 25.09 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.452 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -76.84 48.08 2.61 Favored Glycine 0 N--CA 1.485 1.937 0 C-N-CA 119.133 -1.508 . . . . 0.0 109.572 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.407 ' H ' ' C ' ' A' ' 36' ' ' THR . 1.1 pp20? -153.59 2.43 0.27 Allowed 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.641 -0.917 . . . . 0.0 109.172 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 m -81.33 139.62 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 120.892 -1.13 . . . . 0.0 109.187 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.485 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m80 -79.09 140.74 37.78 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.416 ' C ' ' H ' ' A' ' 43' ' ' GLY . 74.3 mt -46.9 -57.31 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.156 -0.965 . . . . 0.0 109.476 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.77 -10.26 8.15 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.399 -1.481 . . . . 0.0 109.399 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.485 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -80.69 -24.26 58.68 Favored Glycine 0 N--CA 1.481 1.671 0 N-CA-C 106.51 -2.636 . . . . 0.0 106.51 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 45' ' ' MET . 0.4 OUTLIER -73.48 -55.65 11.89 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 114.681 -0.759 . . . . 0.0 109.094 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.534 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 39.7 mtm -46.22 -32.04 2.81 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.26 -0.9 . . . . 0.0 108.942 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tt -71.65 -28.9 64.07 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.12 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -88.82 -59.26 2.28 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.125 -1.609 . . . . 0.0 111.748 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.69 -55.78 6.03 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.762 -1.211 . . . . 0.0 109.001 -178.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 72.7 t -51.81 -50.82 31.06 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 C-N-CA 119.931 -0.708 . . . . 0.0 109.875 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -47.68 -41.13 21.81 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.914 -1.116 . . . . 0.0 109.566 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -68.11 -38.45 82.28 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.289 -0.882 . . . . 0.0 109.861 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.422 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -66.51 -69.44 0.3 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.17 -0.956 . . . . 0.0 108.829 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.422 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 7.7 t70 75.07 83.29 0.1 Allowed 'General case' 0 N--CA 1.488 1.438 0 CA-C-O 121.977 0.894 . . . . 0.0 109.977 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.562 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.0 p -168.77 150.89 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.977 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.63 27.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.524 -0.735 . . . . 0.0 109.448 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.562 ' H ' ' C ' ' A' ' 54' ' ' VAL . 9.0 ttpp -78.75 147.36 33.41 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.902 -1.124 . . . . 0.0 109.634 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -69.48 112.53 6.07 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.543 -0.723 . . . . 0.0 109.249 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.601 ' CA ' ' HD1' ' A' ' 61' ' ' HIS . 79.3 m95 -108.39 -42.78 4.49 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.462 -0.774 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.8 t -45.45 -55.09 6.51 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 109.643 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -51.03 -33.98 27.67 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.601 ' HD1' ' CA ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -71.41 115.46 10.61 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 121.943 0.878 . . . . 0.0 109.261 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -121.15 164.28 17.13 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.57 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -93.87 141.16 28.83 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.882 -1.136 . . . . 0.0 110.97 -177.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.511 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.34 140.99 51.57 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -101.85 91.84 4.55 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -55.56 -21.99 19.69 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.122 -0.986 . . . . 0.0 111.005 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.488 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -65.62 -19.38 65.89 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 105.647 -1.982 . . . . 0.0 105.647 178.154 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -123.22 -12.66 7.84 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.441 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 53.9 45.36 27.91 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -177.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -112.64 -173.93 2.35 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.492 0.663 . . . . 0.0 110.032 -178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.33 5.59 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.602 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 15.8 mt -62.05 84.1 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.122 0 O-C-N 120.231 -1.543 . . . . 0.0 110.278 -176.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -113.6 14.02 18.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.565 ' NZ ' ' CZ ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -85.48 66.44 9.68 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.807 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.9 m -64.99 -6.7 9.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.0 109.776 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -84.43 -35.82 22.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.164 -0.96 . . . . 0.0 110.07 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.0 m95 -91.65 -160.25 0.71 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.115 -0.991 . . . . 0.0 109.505 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.615 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -150.01 169.18 21.81 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 122.086 0.946 . . . . 0.0 109.238 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.433 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 9.1 mp -43.65 -63.81 0.77 Allowed 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.994 0.902 . . . . 0.0 109.257 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -43.01 -51.37 5.71 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.875 0.845 . . . . 0.0 110.075 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.615 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -45.44 -53.92 8.09 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-O 121.617 0.723 . . . . 0.0 109.794 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.565 ' CZ ' ' NZ ' ' A' ' 74' ' ' LYS . 10.5 m-85 -77.33 -40.21 44.98 Favored 'General case' 0 C--N 1.298 -1.653 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.524 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.21 10.47 10.75 Favored Glycine 0 N--CA 1.5 2.952 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.535 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.4 mt -61.09 160.19 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 O-C-N 121.537 -0.978 . . . . 0.0 108.937 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.535 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.83 -167.13 0.47 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.364 -0.835 . . . . 0.0 109.359 -179.38 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.63 -23.79 66.22 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 110.169 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -78.51 -8.03 58.12 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.237 -0.914 . . . . 0.0 108.673 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.69 26.23 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.5 mmtp -93.17 119.92 32.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.992 -1.067 . . . . 0.0 109.067 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.7 mt -99.32 176.03 5.67 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 121.795 0.807 . . . . 0.0 110.5 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.511 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.1 mt-30 -133.63 147.44 51.47 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.417 ' CD2' HD12 ' A' ' 63' ' ' LEU . 4.2 m-85 -113.27 97.64 6.61 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.761 0 O-C-N 121.298 -0.876 . . . . 0.0 111.28 -177.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m . . . . . 0 N--CA 1.488 1.431 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.69 135.66 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.883 -1.135 . . . . 0.0 110.271 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.62 103.93 13.34 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 105.811 -1.922 . . . . 0.0 105.811 178.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.7 t -50.62 126.79 16.41 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.124 0.964 . . . . 0.0 109.727 -177.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.92 5.17 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 106.208 -2.757 . . . . 0.0 106.208 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.34 -35.85 7.39 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.416 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.3 mm-40 55.68 56.4 6.2 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 122.656 1.217 . . . . 0.0 110.138 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -140.49 123.45 10.03 Favored Pre-proline 0 C--N 1.293 -1.865 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -44.29 134.99 8.9 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 120.534 1.227 . . . . 0.0 114.485 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.5 mt -93.92 98.2 7.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 24.7 p -100.07 91.13 4.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.228 -0.92 . . . . 0.0 111.333 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.17 -97.07 0.16 Allowed Glycine 0 N--CA 1.486 2.028 0 N-CA-C 107.063 -2.415 . . . . 0.0 107.063 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.464 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 0.9 OUTLIER -111.94 150.64 30.23 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 177.878 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.32 125.78 14.89 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.227 1.013 . . . . 0.0 111.411 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.0 mt -91.09 147.41 5.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.719 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 8.7 m -118.14 146.93 43.8 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 121.786 0.803 . . . . 0.0 109.072 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.22 -129.14 0.26 Allowed 'General case' 0 C--N 1.295 -1.768 0 CA-C-O 121.593 0.711 . . . . 0.0 109.359 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.6 mtt -65.65 26.28 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.21 -9.16 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -178.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -82.28 162.17 22.38 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -103.9 174.31 5.93 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -159.75 138.55 10.75 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 118.211 -1.395 . . . . 0.0 109.861 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.605 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.6 m80 -57.89 116.99 16.22 Favored Pre-proline 0 C--N 1.299 -1.63 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.545 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 53.1 Cg_exo -45.38 -9.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.403 0 CA-C-N 120.33 1.154 . . . . 0.0 111.793 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.605 ' N ' ' O ' ' B' ' 569' ' ' HIS . 7.9 mt-10 -100.02 -52.33 3.45 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.155 0.979 . . . . 0.0 109.977 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.445 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 22.0 m170 -58.21 -3.35 0.25 Allowed 'General case' 0 C--N 1.293 -1.884 0 O-C-N 120.696 -1.252 . . . . 0.0 109.9 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.498 ' H ' ' C ' ' B' ' 571' ' ' GLU . 31.2 t80 -127.68 57.53 1.52 Allowed 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . 0.425 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.48 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.717 0.77 . . . . 0.0 111.403 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.466 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.86 146.12 35.86 Favored 'General case' 0 N--CA 1.504 2.266 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.36 74.69 3.33 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 116.623 -2.031 . . . . 0.0 109.974 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -63.66 0.14 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 101.962 -3.347 . . . . 0.0 101.962 172.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.2 p -114.22 80.42 1.39 Allowed 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 112.356 -2.202 . . . . 0.0 105.108 176.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.2 16.99 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 -176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.05 -36.23 17.08 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 119.687 -1.883 . . . . 0.0 112.691 -178.606 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.545 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.6 tp60 -159.47 139.59 11.9 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 119.295 -2.128 . . . . 0.0 115.138 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.466 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 19.2 tp -141.33 168.83 18.85 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.43 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 63.9 m-20 -148.25 140.24 23.99 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -0.965 . . . . 0.0 109.092 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.719 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 4.6 ptpp? -57.6 -19.65 27.35 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.394 -0.816 . . . . 0.0 109.636 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.3 -17.22 57.72 Favored Glycine 0 N--CA 1.485 1.96 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.11 25.35 4.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.943 -0.739 . . . . 0.0 109.422 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.519 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.12 114.45 26.39 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-O 122.283 1.04 . . . . 0.0 109.408 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -106.16 167.1 10.04 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 179.074 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.7 tt0 -153.48 157.54 40.0 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.618 -1.301 . . . . 0.0 111.323 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.54 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.2 tp-100 -156.81 146.21 20.5 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 178.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.589 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 47.07 23.55 0.3 Allowed 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.939 -1.101 . . . . 0.0 109.609 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.9 m-20 81.51 -6.0 1.54 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.759 -0.588 . . . . 0.0 110.973 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -88.17 118.1 69.17 Favored Pre-proline 0 C--N 1.295 -1.789 0 O-C-N 121.16 -0.963 . . . . 0.0 110.005 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.542 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.1 Cg_exo -49.87 164.45 0.4 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 CA-C-N 119.988 1.031 . . . . 0.0 111.855 179.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.542 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.73 137.98 1.36 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.276 -0.89 . . . . 0.0 109.877 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.06 156.6 35.66 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.436 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.61 -56.4 20.24 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 178.526 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.46 -28.63 0.94 Allowed 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 21.1 m -84.14 -65.88 0.96 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.449 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.7 OUTLIER -45.6 -52.29 10.83 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.594 0.712 . . . . 0.0 109.583 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.449 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -59.9 -40.95 90.51 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.574 -0.704 . . . . 0.0 109.393 -178.489 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -57.46 -26.27 60.97 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.157 -0.965 . . . . 0.0 110.25 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -93.73 -56.66 2.82 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.028 -1.045 . . . . 0.0 111.123 -178.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.5 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 0.3 OUTLIER -100.5 -29.62 12.26 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.178 -0.951 . . . . 0.0 110.727 -178.112 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.439 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 2.4 t . . . . . 0 N--CA 1.501 2.102 0 O-C-N 121.048 -1.033 . . . . 0.0 109.682 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.699 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -90.19 122.53 33.21 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.454 -1.027 . . . . 0.0 109.544 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.65 121.44 32.15 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.51 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.7 128.73 35.82 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.073 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.45 135.03 34.83 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.246 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.07 145.85 35.58 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.399 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.7 t -137.81 111.07 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 CA-C-O 121.923 0.868 . . . . 0.0 109.756 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.514 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 6.9 m-70 -85.8 103.59 14.71 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.1 t -73.03 82.8 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 O-C-N 121.159 -0.963 . . . . 0.0 109.192 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.62 166.4 0.93 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.77 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.5 t0 73.48 -46.3 0.63 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.543 ' H ' ' C ' ' A' ' 25' ' ' THR . 0.3 OUTLIER -85.76 -36.34 20.2 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.345 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.532 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 75.72 13.28 2.91 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.339 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 -90.41 -177.81 5.18 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.12 -0.988 . . . . 0.0 109.144 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.514 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 18.1 m-20 -144.45 116.87 8.54 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 19.9 t -119.41 157.4 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.693 0.759 . . . . 0.0 110.062 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.12 133.01 42.34 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -113.84 113.24 24.63 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.705 -0.622 . . . . 0.0 109.334 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -59.95 105.95 0.45 Allowed 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.1 m -134.25 -169.51 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-O 121.988 0.899 . . . . 0.0 110.4 -178.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.422 ' H ' HG11 ' A' ' 39' ' ' VAL . 5.3 p -142.5 174.64 10.45 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 179.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.09 44.65 2.65 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.414 ' O ' ' OE2' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -145.58 4.07 1.01 Allowed 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.602 -0.94 . . . . 0.0 108.956 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.422 HG11 ' H ' ' A' ' 36' ' ' THR . 2.9 m -88.9 137.72 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.073 -1.017 . . . . 0.0 110.193 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.482 ' O ' ' N ' ' A' ' 43' ' ' GLY . 3.8 m-70 -79.25 144.38 34.39 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.138 -0.976 . . . . 0.0 108.912 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 87.9 mt -45.74 -58.54 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.257 -0.902 . . . . 0.0 110.175 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.07 -13.58 4.93 Favored Glycine 0 C--N 1.296 -1.677 0 N-CA-C 108.734 -1.746 . . . . 0.0 108.734 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.95 -26.33 58.47 Favored Glycine 0 N--CA 1.48 1.621 0 N-CA-C 108.54 -1.824 . . . . 0.0 108.54 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -83.32 -53.95 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.469 -1.018 . . . . 0.0 110.642 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -27.68 44.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.222 -1.549 . . . . 0.0 108.862 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -64.13 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -52.28 -53.99 37.07 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.431 -0.793 . . . . 0.0 110.17 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.5 tp -44.93 -51.52 9.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.508 -0.745 . . . . 0.0 110.098 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.81 -47.13 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.815 -1.178 . . . . 0.0 109.008 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -48.03 -40.62 23.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.275 -0.891 . . . . 0.0 109.474 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -69.21 -43.87 73.23 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.406 -0.809 . . . . 0.0 110.011 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -48.96 -58.1 5.43 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.566 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.4 t70 74.0 75.47 0.12 Allowed 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.938 0.875 . . . . 0.0 110.135 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.542 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -175.16 132.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.292 -1.905 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -69.46 35.86 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.458 -0.776 . . . . 0.0 109.381 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.542 ' H ' ' C ' ' A' ' 54' ' ' VAL . 39.4 tttp -78.95 135.42 36.94 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.628 -1.295 . . . . 0.0 108.681 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.406 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 14.3 t70 -50.02 119.72 3.83 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.223 -0.923 . . . . 0.0 108.958 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 55.1 m95 -120.23 -35.93 3.34 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.58 -0.7 . . . . 0.0 110.539 -179.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 58' ' ' TRP . 8.2 t -43.15 -50.27 6.28 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.293 -0.879 . . . . 0.0 109.164 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -55.52 -43.06 75.38 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.705 ' HD1' ' H ' ' A' ' 61' ' ' HIS . 0.4 OUTLIER -71.16 115.15 9.97 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.582 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -129.56 168.99 15.58 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 91' ' ' GLN . 0.3 OUTLIER -95.71 149.37 21.55 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 122.289 1.042 . . . . 0.0 110.679 -178.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.623 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -141.6 142.87 33.46 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 -178.71 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.541 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -94.96 90.8 6.1 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.292 -1.505 . . . . 0.0 108.955 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.416 ' C ' ' N ' ' A' ' 68' ' ' LYS . 14.3 pt-20 -55.44 -23.46 25.41 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.069 -1.019 . . . . 0.0 110.585 -179.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.467 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 12.6 mmtp -66.53 -10.4 44.57 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.416 ' N ' ' C ' ' A' ' 66' ' ' GLU . 17.7 mmtt -133.29 -11.08 2.87 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.616 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.3 mpp_? 52.73 47.18 25.24 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.503 ' HG1' ' H ' ' A' ' 71' ' ' TRP . 4.0 t -115.43 -172.15 2.09 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.472 0.653 . . . . 0.0 109.834 -178.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.56 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.8 99.21 5.04 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 177.02 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.38 87.72 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.182 0 O-C-N 120.667 -1.271 . . . . 0.0 108.832 -176.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 13.01 12.55 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.96 74.72 9.67 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -25.22 68.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.909 -1.12 . . . . 0.0 108.354 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.48 ' O ' ' CE3' ' A' ' 77' ' ' TRP . 2.8 t60 -82.83 73.71 9.84 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.48 ' CE3' ' O ' ' A' ' 76' ' ' HIS . 0.1 OUTLIER 161.04 -167.77 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 -179.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.642 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -149.44 -172.0 4.03 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.776 -1.202 . . . . 0.0 109.432 -179.756 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.506 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.1 mp -62.49 -58.82 6.24 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -42.95 -50.98 5.77 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.695 0.76 . . . . 0.0 109.874 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.642 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -46.54 -54.39 9.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-O 121.58 0.705 . . . . 0.0 109.684 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -73.71 -41.11 63.04 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.117 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 114.11 8.8 16.83 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 108.131 -1.988 . . . . 0.0 108.131 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 58.9 mt -61.07 157.94 2.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.755 -0.85 . . . . 0.0 109.135 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.16 -165.78 1.04 Allowed 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.61 -24.85 63.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.468 -0.77 . . . . 0.0 110.022 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.4 p30 -78.6 -7.98 58.15 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 108.769 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.61 26.12 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.0 mmtp -93.82 116.02 28.46 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.982 -1.074 . . . . 0.0 110.018 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.2 mt -91.16 176.65 6.51 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.623 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.9 mt-30 -135.6 171.73 14.03 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.54 97.62 3.19 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.417 ' CB ' ' OG1' ' A' ' 25' ' ' THR . 3.0 t . . . . . 0 N--CA 1.491 1.582 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.85 -177.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.531 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.0 m . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.86 136.39 57.96 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.407 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 103.9 13.3 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -51.1 126.96 17.83 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.198 0.999 . . . . 0.0 109.641 -177.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -34.56 5.42 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.172 -2.771 . . . . 0.0 106.172 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.73 -35.47 7.36 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 178.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.423 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.3 mm-40 55.08 56.22 6.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 122.742 1.258 . . . . 0.0 110.025 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -141.02 125.02 10.31 Favored Pre-proline 0 C--N 1.293 -1.856 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -44.24 137.65 7.5 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 120.372 1.169 . . . . 0.0 114.993 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.531 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.8 mt -96.58 98.72 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.007 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 71.8 p -99.84 93.41 5.78 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.234 -0.916 . . . . 0.0 111.356 -177.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 153.25 -95.4 0.15 Allowed Glycine 0 N--CA 1.487 2.082 0 N-CA-C 107.406 -2.278 . . . . 0.0 107.406 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.477 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.29 152.48 31.3 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.1 p -144.48 126.19 15.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.012 -1.055 . . . . 0.0 111.265 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.8 mt -90.6 146.5 6.12 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.702 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.8 m -118.51 146.74 44.3 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 121.888 0.852 . . . . 0.0 109.049 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.761 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.85 -129.0 0.25 Allowed 'General case' 0 C--N 1.295 -1.79 0 CA-C-O 121.607 0.718 . . . . 0.0 109.407 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 14.1 mtp -65.57 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.761 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.02 -8.75 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -178.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -81.84 159.93 23.62 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt -102.91 174.47 5.86 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.69 136.18 8.01 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.231 -1.388 . . . . 0.0 109.957 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.588 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.79 115.81 10.52 Favored Pre-proline 0 C--N 1.3 -1.567 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 177.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.7 Cg_exo -46.22 -8.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.452 0 CA-C-N 120.353 1.162 . . . . 0.0 111.814 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' B' ' 569' ' ' HIS . 12.2 mt-10 -100.64 -52.84 3.23 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.021 0.915 . . . . 0.0 110.06 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.523 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.2 m170 -57.03 -4.7 0.19 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.848 -1.157 . . . . 0.0 109.863 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.516 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.6 t80 -124.77 54.53 1.4 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 178.198 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . 0.424 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 15.7 m -93.74 177.6 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.827 0.823 . . . . 0.0 110.738 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.467 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -76.9 149.33 36.07 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -96.35 76.07 2.95 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 116.787 -1.965 . . . . 0.0 110.736 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.84 -56.97 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 172.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.8 p -117.21 121.99 42.74 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 112.535 -2.121 . . . . 0.0 106.772 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 10.8 mp -75.01 14.19 0.56 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 121.05 -1.031 . . . . 0.0 111.981 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.27 -39.5 11.48 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 119.361 -2.087 . . . . 0.0 115.277 -175.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -162.72 141.57 8.79 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 122.513 2.415 . . . . 0.0 116.332 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.467 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 19.7 tp -142.04 168.69 19.15 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 174.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.504 ' O ' ' N ' ' B' ' 587' ' ' PHE . 72.2 m-20 -149.82 135.86 18.76 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.917 -1.114 . . . . 0.0 109.048 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.702 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 1.2 ptpp? -54.87 -14.37 1.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.21 -0.931 . . . . 0.0 109.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . 0.41 ' H ' ' C ' ' B' ' 583' ' ' ASN . . . -94.72 -15.5 45.93 Favored Glycine 0 N--CA 1.486 2.019 0 N-CA-C 108.735 -1.746 . . . . 0.0 108.735 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.1 p -136.72 26.17 3.07 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.907 -0.76 . . . . 0.0 108.983 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 2.2 p90 -89.25 108.18 19.47 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 122.446 1.117 . . . . 0.0 109.338 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.56 165.63 11.53 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.429 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -153.2 157.29 40.02 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 122.656 1.217 . . . . 0.0 110.718 -178.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.507 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -156.56 145.96 20.62 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.592 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 46.79 23.58 0.27 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.037 -1.039 . . . . 0.0 109.497 -179.642 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.48 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 82.55 -7.19 1.29 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.818 -0.551 . . . . 0.0 110.865 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -87.83 116.45 66.2 Favored Pre-proline 0 C--N 1.295 -1.763 0 O-C-N 121.123 -0.986 . . . . 0.0 110.067 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.3 Cg_exo -50.26 164.34 0.49 Allowed 'Trans proline' 0 N--CA 1.488 1.176 0 CA-C-N 120.026 1.045 . . . . 0.0 111.698 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 24.2 m-85 -170.4 140.5 1.83 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.259 -0.901 . . . . 0.0 109.837 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.7 m -69.63 154.72 41.59 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 175.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.422 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.7 -56.97 15.34 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 178.481 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.31 -30.04 1.9 Allowed 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 6.6 m -81.24 -63.14 1.46 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.554 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.48 -54.34 28.07 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.437 0.637 . . . . 0.0 110.375 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.554 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -52.78 -41.8 64.44 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.375 -0.828 . . . . 0.0 109.902 -178.07 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.83 -23.22 66.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.031 -1.043 . . . . 0.0 110.719 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.86 -56.3 3.14 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.571 -1.331 . . . . 0.0 111.915 -177.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.449 ' C ' ' SG ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -103.7 4.77 35.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.185 -0.947 . . . . 0.0 111.155 -177.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.449 ' SG ' ' C ' ' B' ' 604' ' ' PHE . 2.1 m . . . . . 0 N--CA 1.498 1.95 0 O-C-N 120.714 -1.241 . . . . 0.0 109.445 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.838 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.541 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.1 OUTLIER -98.61 126.84 44.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.383 -1.069 . . . . 0.0 109.839 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.5 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.5 OUTLIER -128.58 123.86 34.46 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.296 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.83 137.75 39.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.903 . . . . 0.0 109.561 -179.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.23 129.17 34.86 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.06 143.29 37.55 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.882 -1.136 . . . . 0.0 108.353 179.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.47 153.24 30.61 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-O 121.65 0.738 . . . . 0.0 109.415 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.421 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 24.5 m80 -123.26 102.16 7.78 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.005 -1.479 . . . . 0.0 107.005 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.96 102.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.536 ' C ' ' H ' ' A' ' 27' ' ' LEU . 53.9 p -75.72 -35.39 60.26 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.34 -0.85 . . . . 0.0 109.675 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -76.01 19.05 0.24 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.181 -0.95 . . . . 0.0 108.496 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.536 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -154.74 -28.51 0.11 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.627 -0.671 . . . . 0.0 109.203 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.2 OUTLIER 82.97 12.64 0.46 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 122.135 -0.353 . . . . 0.0 110.199 -179.534 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -95.27 -178.32 4.41 Favored 'General case' 0 C--N 1.309 -1.181 0 O-C-N 120.85 -1.157 . . . . 0.0 109.881 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.421 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 1.3 m-20 -138.44 121.04 16.22 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.257 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.7 t -119.46 154.58 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.788 0.804 . . . . 0.0 110.577 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.8 128.89 41.62 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -115.1 115.31 26.58 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.39 0.614 . . . . 0.0 110.034 -178.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.541 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.7 tpt180 -59.62 112.29 1.74 Allowed 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -140.73 -171.21 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.983 0.897 . . . . 0.0 110.461 -179.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 p -144.43 176.22 9.54 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.85 44.57 3.14 Favored Glycine 0 N--CA 1.481 1.681 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -145.61 1.68 0.92 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.589 -0.948 . . . . 0.0 108.881 178.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 m -89.14 134.0 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.939 -1.101 . . . . 0.0 109.547 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.516 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.8 m-70 -73.45 147.37 44.22 Favored 'General case' 0 C--N 1.29 -2.001 0 O-C-N 120.948 -1.095 . . . . 0.0 108.175 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.453 ' C ' ' H ' ' A' ' 43' ' ' GLY . 81.6 mt -48.75 -51.39 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 120.998 -1.064 . . . . 0.0 108.947 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.52 -10.87 6.42 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 108.482 -1.847 . . . . 0.0 108.482 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -74.93 -26.82 65.88 Favored Glycine 0 N--CA 1.483 1.773 0 N-CA-C 107.919 -2.073 . . . . 0.0 107.919 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 45' ' ' MET . 2.1 t -84.13 -42.95 17.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.404 ' C ' ' O ' ' A' ' 44' ' ' VAL . 40.9 mtm -45.51 -36.25 4.4 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.26 -65.81 0.73 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 121.398 0.618 . . . . 0.0 110.095 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.4 ' O ' ' C ' ' A' ' 48' ' ' LEU . 48.2 mttm -52.88 -55.67 21.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.446 -0.783 . . . . 0.0 111.275 -178.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -45.05 -56.69 4.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.946 -1.097 . . . . 0.0 109.759 -178.524 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.5 t -60.64 -47.36 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.04 -1.037 . . . . 0.0 110.117 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.446 ' CD ' ' HZ1' ' B' ' 593' ' ' LYS . 65.1 mm-40 -45.06 -39.63 5.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.153 -0.967 . . . . 0.0 109.85 -179.301 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -65.52 -57.06 9.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.318 -0.864 . . . . 0.0 110.392 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -67.17 0.45 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t0 62.62 89.03 0.09 Allowed 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.863 0.839 . . . . 0.0 109.242 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.576 ' O ' ' N ' ' A' ' 56' ' ' LYS . 1.6 p -155.67 33.13 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.303 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 tptt 41.23 17.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.778 -0.576 . . . . 0.0 110.649 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.576 ' N ' ' O ' ' A' ' 54' ' ' VAL . 16.7 ttmm -78.7 146.72 33.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.967 -1.083 . . . . 0.0 109.027 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.53 115.09 2.12 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.509 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 60.4 m95 -117.72 -33.66 4.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.609 -0.682 . . . . 0.0 109.905 -179.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.5 t -42.99 -55.78 3.62 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.433 -0.792 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -50.99 -43.65 60.76 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.211 -0.93 . . . . 0.0 108.521 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.413 ' HD1' ' H ' ' A' ' 61' ' ' HIS . 8.5 m80 -72.45 134.17 45.21 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.732 0.777 . . . . 0.0 110.214 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.86 -179.31 6.51 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.564 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -95.12 137.73 33.77 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.812 -1.18 . . . . 0.0 110.682 -179.384 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.474 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -125.88 148.97 49.03 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.55 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -105.13 92.08 4.07 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.711 -1.243 . . . . 0.0 108.708 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -54.31 -23.57 15.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.255 -0.903 . . . . 0.0 110.734 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.497 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 23.7 mmtp -67.82 -10.56 53.95 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -134.0 -11.43 2.6 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.132 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.55 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.63 45.84 27.86 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -111.93 -171.05 1.77 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.322 0.582 . . . . 0.0 109.804 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.551 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.56 99.68 5.46 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 177.608 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 36.1 mt -60.07 88.47 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.69 1.233 . . . . 0.0 110.634 -176.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.476 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.0 pp -123.04 13.04 9.71 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 178.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.525 ' C ' ' H ' ' A' ' 76' ' ' HIS . 10.1 mmpt? -75.37 43.18 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.735 -0.603 . . . . 0.0 109.966 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.7 m -54.75 -6.37 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.982 -1.074 . . . . 0.0 109.58 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.525 ' H ' ' C ' ' A' ' 74' ' ' LYS . 87.2 m-70 -55.97 -68.57 0.19 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.252 -0.905 . . . . 0.0 110.861 -179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -99.05 -115.86 0.15 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.137 -0.977 . . . . 0.0 110.636 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.41 155.44 36.37 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 -178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.543 ' O ' ' N ' ' A' ' 82' ' ' TYR . 1.2 pt? -43.8 -51.1 7.58 Favored 'General case' 0 C--N 1.295 -1.78 0 O-C-N 121.275 -0.89 . . . . 0.0 110.654 179.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.454 ' H ' HD21 ' A' ' 79' ' ' LEU . 17.6 t70 -45.49 -32.25 2.13 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.213 -0.929 . . . . 0.0 109.852 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.525 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -72.55 -32.01 65.72 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 -179.623 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.543 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.5 OUTLIER -73.33 -49.55 26.79 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 124.28 4.55 7.64 Favored Glycine 0 N--CA 1.51 3.619 0 N-CA-C 108.65 -1.78 . . . . 0.0 108.65 179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.9 mt -60.08 162.29 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -156.22 -164.64 1.73 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.048 -1.033 . . . . 0.0 108.741 178.697 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.57 -21.27 60.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.175 -0.953 . . . . 0.0 109.833 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.1 3.24 43.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.335 -0.853 . . . . 0.0 109.402 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.98 113.61 25.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.355 -0.841 . . . . 0.0 109.315 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -97.39 125.77 42.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.059 -1.026 . . . . 0.0 109.228 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.6 mt -112.7 178.61 4.23 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.714 0.769 . . . . 0.0 109.388 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.474 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.2 mt-30 -129.9 168.19 17.01 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -123.73 90.88 3.35 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.061 0 O-C-N 121.737 -0.602 . . . . 0.0 110.332 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.543 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.1 m . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.18 137.13 58.24 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.23 -0.919 . . . . 0.0 110.653 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.86 103.84 13.46 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 178.197 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.5 t -49.62 125.99 12.66 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.086 0.946 . . . . 0.0 109.624 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.33 -34.95 5.2 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 106.444 -2.663 . . . . 0.0 106.444 -177.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.17 -35.29 7.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.6 mm-40 55.01 56.27 6.77 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 122.694 1.235 . . . . 0.0 109.899 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt -140.83 124.7 10.34 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -43.7 138.29 5.8 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 CA-C-N 120.428 1.189 . . . . 0.0 114.83 -178.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.543 ' N ' ' O ' ' B' ' 547' ' ' SER . 41.6 mt -97.61 98.69 7.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 51.8 p -100.06 91.35 4.74 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 121.955 0.883 . . . . 0.0 111.234 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.41 -96.66 0.16 Allowed Glycine 0 N--CA 1.488 2.102 0 N-CA-C 107.349 -2.3 . . . . 0.0 107.349 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.484 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 6.0 mmt-85 -113.08 153.02 28.84 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.5 p -144.83 126.47 15.13 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.022 -1.049 . . . . 0.0 111.425 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.4 mt -90.61 146.15 6.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 10.9 m -121.5 146.61 46.75 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.0 0.905 . . . . 0.0 109.151 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.724 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -128.92 0.26 Allowed 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.9 mtp -65.75 25.88 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.724 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.0 -8.56 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.84 149.07 28.5 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.5 mmmt -96.02 174.72 6.78 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.43 134.67 7.3 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.436 -1.306 . . . . 0.0 109.939 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.581 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.2 m80 -55.42 114.8 7.87 Favored Pre-proline 0 C--N 1.303 -1.428 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 177.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.577 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.1 Cg_exo -45.67 -10.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 CA-C-N 120.306 1.145 . . . . 0.0 111.964 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' B' ' 569' ' ' HIS . 5.9 mt-10 -100.64 -53.01 3.19 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 122.052 0.93 . . . . 0.0 110.067 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.56 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.7 m170 -55.41 -5.92 0.15 Allowed 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.589 -1.319 . . . . 0.0 109.839 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.509 ' H ' ' C ' ' B' ' 571' ' ' GLU . 21.2 t80 -124.27 52.53 1.49 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 11.4 m -93.47 176.89 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 CA-C-O 121.514 0.673 . . . . 0.0 110.125 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.453 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.44 144.03 38.12 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 107.597 -1.261 . . . . 0.0 107.597 179.029 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -90.89 74.09 6.49 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 116.258 -2.177 . . . . 0.0 109.488 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -153.99 -65.85 0.14 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 172.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.528 ' O ' ' N ' ' B' ' 580' ' ' LYS . 17.0 p -110.67 84.03 1.86 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 112.514 -2.13 . . . . 0.0 105.616 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . 0.627 ' CD1' ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.49 15.1 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.528 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.67 -38.7 15.64 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 119.542 -1.973 . . . . 0.0 112.542 -178.267 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.577 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.25 142.16 9.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 119.5 -2.0 . . . . 0.0 115.02 178.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.453 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.7 tp -136.7 170.1 16.63 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 175.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.502 ' O ' ' N ' ' B' ' 587' ' ' PHE . 77.2 m-20 -145.2 129.26 17.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.066 -1.022 . . . . 0.0 109.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -50.84 -22.64 2.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.522 -0.736 . . . . 0.0 109.651 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.12 -18.1 59.89 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.004 -1.638 . . . . 0.0 109.004 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 586' ' ' THR . . . . . 0.436 ' N ' ' O ' ' B' ' 583' ' ' ASN . 2.9 p -133.12 26.31 4.22 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.568 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.3 OUTLIER -89.48 108.53 19.7 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.579 1.18 . . . . 0.0 109.974 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.44 168.4 10.01 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.411 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.46 157.15 40.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.747 -1.221 . . . . 0.0 110.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.532 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.6 tp60 -150.84 144.2 24.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.553 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 41.98 27.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.217 -0.927 . . . . 0.0 110.452 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 3.6 m-20 84.26 -8.37 0.98 Allowed 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.758 -0.588 . . . . 0.0 111.05 179.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . 0.446 ' HZ1' ' CD ' ' A' ' 50' ' ' GLU . 53.2 mttt -88.18 116.78 67.26 Favored Pre-proline 0 C--N 1.296 -1.732 0 O-C-N 121.162 -0.961 . . . . 0.0 109.973 -179.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.2 Cg_exo -50.2 163.93 0.54 Allowed 'Trans proline' 0 N--CA 1.492 1.434 0 CA-C-N 119.887 0.995 . . . . 0.0 112.576 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.526 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 21.6 m-85 -170.84 139.65 1.51 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.404 -0.81 . . . . 0.0 109.589 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 10.0 m -68.5 157.23 36.4 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 175.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.438 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.2 -55.58 32.05 Favored 'General case' 0 C--N 1.294 -1.836 0 C-N-CA 117.253 -1.779 . . . . 0.0 106.56 179.203 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.5 -31.28 2.64 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.331 -0.856 . . . . 0.0 109.182 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.28 -56.52 4.15 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.456 ' CD2' ' OE1' ' B' ' 590' ' ' GLN . 2.4 t80 -60.32 -53.53 56.56 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.443 0.64 . . . . 0.0 110.498 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.45 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.45 -43.34 62.06 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.117 -0.989 . . . . 0.0 109.431 -178.348 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.82 -20.43 50.36 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.994 -1.066 . . . . 0.0 110.163 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 1.2 mt -91.98 -56.93 2.89 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.651 -1.28 . . . . 0.0 110.331 -178.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' C ' ' B' ' 605' ' ' CYS . 24.5 m-85 -106.41 32.36 4.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.508 -0.745 . . . . 0.0 109.935 -179.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' B' ' 604' ' ' PHE . 3.9 t . . . . . 0 N--CA 1.502 2.145 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.759 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.534 ' OG1' ' N ' ' A' ' 18' ' ' TRP . 2.7 t -167.85 178.46 5.2 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 117.548 -1.661 . . . . 0.0 111.693 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.534 ' N ' ' OG1' ' A' ' 17' ' ' THR . 0.5 OUTLIER -165.48 127.87 2.09 Favored 'General case' 0 C--N 1.277 -2.552 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.673 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.516 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -83.78 132.21 34.85 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.961 -1.087 . . . . 0.0 109.521 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.488 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.86 133.51 34.73 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.174 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.15 145.73 35.49 Favored 'General case' 0 C--N 1.295 -1.797 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.176 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -137.35 114.11 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.7 0.762 . . . . 0.0 110.015 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -85.76 103.77 14.84 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.538 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.63 107.01 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.577 ' C ' ' H ' ' A' ' 27' ' ' LEU . 41.5 p -78.2 -41.08 35.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.327 -0.858 . . . . 0.0 110.037 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -73.02 20.53 0.08 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.055 -1.028 . . . . 0.0 108.793 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.7 mt -154.49 -33.0 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.538 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 85.23 14.09 0.19 Allowed 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 120.707 0.289 . . . . 0.0 110.429 -179.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.0 mtp-105 -95.58 -178.27 4.35 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 120.911 -1.118 . . . . 0.0 110.036 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -135.86 116.98 14.39 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.1 t -115.36 155.13 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.681 0.753 . . . . 0.0 110.004 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.37 131.59 38.45 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -118.54 115.91 25.57 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.451 ' CD ' ' C ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -61.6 133.85 56.13 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.459 ' O ' ' OG1' ' A' ' 17' ' ' THR . 13.9 m -160.7 -170.22 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.019 0 CA-C-O 122.071 0.938 . . . . 0.0 110.012 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 38' ' ' GLU . 0.8 OUTLIER -142.13 171.16 14.43 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.047 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -77.58 45.04 2.33 Favored Glycine 0 C--N 1.293 -1.831 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.447 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.7 OUTLIER -144.99 3.49 1.06 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.765 -0.844 . . . . 0.0 108.926 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.414 HG11 ' H ' ' A' ' 36' ' ' THR . 2.6 m -90.1 135.69 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.041 -1.037 . . . . 0.0 110.076 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.515 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.8 OUTLIER -72.5 142.46 48.54 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 120.944 -1.098 . . . . 0.0 108.217 178.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.513 ' C ' ' H ' ' A' ' 43' ' ' GLY . 94.1 mt -47.8 -55.54 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.051 -1.031 . . . . 0.0 109.268 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.413 ' H ' ' CG2' ' A' ' 75' ' ' THR . . . -55.8 -8.9 2.32 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.531 -1.828 . . . . 0.0 108.531 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -75.12 -28.25 62.62 Favored Glycine 0 N--CA 1.484 1.869 0 N-CA-C 107.585 -2.206 . . . . 0.0 107.585 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.29 -40.88 16.53 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.1 mtm -47.64 -35.02 8.73 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.57 -65.72 0.79 Allowed 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.745 -0.597 . . . . 0.0 109.954 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 53.5 mttm -49.39 -59.85 3.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.372 -0.83 . . . . 0.0 110.8 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.51 -55.56 6.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.016 -1.052 . . . . 0.0 109.39 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 70.0 t -56.5 -48.76 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -46.72 -40.71 13.87 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.053 -1.03 . . . . 0.0 109.591 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -76.6 -36.83 57.26 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.411 -0.805 . . . . 0.0 110.853 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -65.01 0.75 Allowed 'General case' 0 C--N 1.305 -1.342 0 O-C-N 120.914 -1.116 . . . . 0.0 108.904 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 67.16 79.25 0.23 Allowed 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 121.822 0.82 . . . . 0.0 109.816 179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.6 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.7 p -171.03 146.06 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 C-N-CA 119.696 -0.802 . . . . 0.0 110.005 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.28 34.91 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.315 -0.866 . . . . 0.0 108.931 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.6 ' H ' ' C ' ' A' ' 54' ' ' VAL . 16.0 ttmm -77.74 161.49 27.67 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.127 -0.983 . . . . 0.0 108.873 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -77.13 90.64 3.66 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 109.027 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.464 ' O ' ' O ' ' A' ' 61' ' ' HIS . 11.1 m0 -72.8 -58.15 3.56 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.344 -0.848 . . . . 0.0 109.106 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.5 t -42.25 -56.87 2.76 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.288 0.565 . . . . 0.0 110.463 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -53.87 -45.99 71.16 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 58' ' ' TRP . 51.6 m170 -72.94 121.03 19.4 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.794 0.807 . . . . 0.0 110.127 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -134.45 177.96 7.36 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.57 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.45 140.47 29.78 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.894 -1.129 . . . . 0.0 109.705 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.488 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.49 151.37 48.93 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.35 94.08 4.84 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.064 -1.022 . . . . 0.0 108.659 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.431 ' OE2' ' OE1' ' A' ' 91' ' ' GLN . 10.6 pt-20 -55.4 -23.42 24.61 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.327 -0.858 . . . . 0.0 110.886 -179.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.508 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.9 mmtp -69.34 -9.32 52.83 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -133.63 -11.81 2.7 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.068 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.6 45.54 28.43 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -112.36 -172.32 2.02 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.441 0.639 . . . . 0.0 109.798 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.535 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.79 99.65 5.63 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 177.391 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.1 mt -59.88 84.93 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.667 1.222 . . . . 0.0 110.73 -176.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -121.92 10.39 10.17 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.534 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -84.66 33.47 0.52 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.413 ' CG2' ' H ' ' A' ' 42' ' ' GLY . 24.0 m -49.63 -10.01 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 0.0 109.579 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.534 ' H ' ' C ' ' A' ' 74' ' ' LYS . 12.8 m80 -55.61 -15.05 2.5 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.187 -0.945 . . . . 0.0 109.89 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -138.07 -122.25 0.13 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.227 -0.921 . . . . 0.0 109.413 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.42 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -151.96 -164.53 2.0 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.15 -1.594 . . . . 0.0 111.11 -178.374 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.542 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.3 mp -71.53 -56.0 6.75 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -43.15 -48.52 6.38 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.667 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -57.15 -30.41 64.42 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.931 -178.59 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.481 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -88.76 -44.7 10.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.135 -0.978 . . . . 0.0 108.575 179.712 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 111.23 27.24 4.29 Favored Glycine 0 N--CA 1.501 3.005 0 N-CA-C 108.515 -1.834 . . . . 0.0 108.515 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.538 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 38.8 mt -82.61 160.96 3.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.788 -0.83 . . . . 0.0 109.614 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -166.65 -173.3 2.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.439 -0.788 . . . . 0.0 108.894 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.48 -22.65 67.03 Favored 'General case' 0 C--N 1.298 -1.673 0 O-C-N 121.466 -0.771 . . . . 0.0 110.137 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.26 -8.84 59.35 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.098 -179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.488 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.04 113.73 26.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.562 -0.711 . . . . 0.0 109.099 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -94.43 117.33 29.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.974 -1.079 . . . . 0.0 109.527 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.9 mt -95.7 176.89 5.98 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.484 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.9 mt-30 -131.88 168.13 18.39 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -122.38 91.9 3.6 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.501 2.091 0 O-C-N 121.65 -0.656 . . . . 0.0 109.834 -177.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -57.28 135.18 56.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.742 -1.224 . . . . 0.0 110.523 -178.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.97 103.99 13.67 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.0 t -49.46 125.86 12.09 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 122.045 0.926 . . . . 0.0 109.786 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.27 -34.77 5.31 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 106.406 -2.678 . . . . 0.0 106.406 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -105.12 -35.75 7.51 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.21 56.45 6.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.736 1.255 . . . . 0.0 109.826 -178.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -140.63 123.89 10.14 Favored Pre-proline 0 C--N 1.294 -1.826 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 177.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -43.84 134.42 7.84 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 CA-C-N 120.429 1.189 . . . . 0.0 114.825 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.54 ' N ' ' O ' ' B' ' 547' ' ' SER . 41.5 mt -93.02 99.99 10.58 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 67.1 p -101.45 93.14 5.24 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.241 -0.912 . . . . 0.0 111.22 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.5 -94.35 0.14 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.323 -2.311 . . . . 0.0 107.323 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.471 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -115.88 152.47 33.33 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.78 126.9 15.61 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.981 -1.074 . . . . 0.0 111.5 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 49.6 mt -91.02 146.27 6.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.628 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 9.3 m -121.03 146.25 46.91 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.939 0.876 . . . . 0.0 109.091 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.722 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.83 -128.87 0.26 Allowed 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 5.9 mtp -65.89 26.09 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.569 -0.707 . . . . 0.0 109.11 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.722 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.28 -8.97 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 148.53 27.89 Favored 'General case' 0 C--N 1.306 -1.298 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -94.65 174.8 6.93 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.64 134.96 7.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.442 -1.303 . . . . 0.0 109.929 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.4 m80 -55.91 115.33 9.36 Favored Pre-proline 0 C--N 1.302 -1.473 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.578 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 44.3 Cg_exo -45.75 -11.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.317 1.149 . . . . 0.0 111.586 -178.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' B' ' 569' ' ' HIS . 11.2 mt-10 -98.3 -52.87 3.52 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 122.102 0.953 . . . . 0.0 110.077 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.532 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.1 m170 -57.04 -4.58 0.19 Allowed 'General case' 0 C--N 1.292 -1.901 0 O-C-N 120.633 -1.292 . . . . 0.0 109.715 -179.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.511 ' H ' ' C ' ' B' ' 571' ' ' GLU . 14.0 t80 -127.55 54.43 1.68 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 13.8 m -93.53 177.58 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 121.624 0.726 . . . . 0.0 110.147 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.442 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.88 141.42 32.24 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.369 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . 0.488 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.52 76.41 6.6 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 116.719 -1.992 . . . . 0.0 108.801 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -153.1 -61.52 0.15 Allowed 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 102.498 -3.149 . . . . 0.0 102.498 174.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 20.8 p -120.16 81.57 1.76 Allowed 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 111.647 -2.524 . . . . 0.0 104.803 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.2 mt -53.02 15.48 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.53 -38.15 17.5 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 119.636 -1.915 . . . . 0.0 112.258 -178.547 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.578 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.8 tp60 -161.09 142.36 11.69 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 119.673 -1.892 . . . . 0.0 114.341 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.442 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 24.0 tp -134.06 171.02 14.79 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 74.0 m-20 -146.77 128.53 15.27 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.186 -0.947 . . . . 0.0 109.468 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.628 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.5 ptpp? -50.66 -19.41 0.92 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.622 -0.673 . . . . 0.0 110.014 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -85.51 -21.15 55.01 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.894 -1.683 . . . . 0.0 108.894 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -133.75 28.63 3.9 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.69 107.05 18.87 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 122.788 1.28 . . . . 0.0 110.288 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.531 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -100.88 168.46 9.62 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 12.0 tt0 -152.4 157.22 40.93 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.795 -1.191 . . . . 0.0 110.673 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.598 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 1.2 tp-100 -154.15 145.83 23.31 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.551 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 45.68 23.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.03 -1.044 . . . . 0.0 109.872 -179.719 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.77 -4.85 1.54 Allowed 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.386 0.612 . . . . 0.0 110.482 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -88.59 121.19 70.24 Favored Pre-proline 0 C--N 1.294 -1.825 0 O-C-N 121.306 -0.871 . . . . 0.0 109.394 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.44 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 49.7 Cg_exo -48.84 164.64 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.22 0 CA-C-N 120.106 1.073 . . . . 0.0 111.782 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.531 ' O ' ' N ' ' B' ' 588' ' ' LYS . 7.4 m-85 -170.75 142.08 1.91 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.024 -1.048 . . . . 0.0 110.373 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 22.4 m -77.8 154.78 31.57 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.467 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.58 -58.3 9.07 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 179.113 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -46.17 -26.64 0.81 Allowed 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.675 -0.64 . . . . 0.0 109.484 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.4 m -85.0 -63.9 1.25 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.544 -0.722 . . . . 0.0 109.099 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -52.49 -53.85 40.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.519 -0.738 . . . . 0.0 109.355 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.619 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -49.59 -42.33 44.33 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.52 -24.73 14.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.364 -0.835 . . . . 0.0 109.559 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.8 mt -93.76 -57.21 2.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.251 -0.906 . . . . 0.0 111.685 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.598 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.6 m-85 -87.16 31.5 0.72 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.046 -1.034 . . . . 0.0 110.253 -178.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.943 -1.098 . . . . 0.0 109.447 179.253 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.429 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.557 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -84.61 125.55 32.55 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.118 -1.225 . . . . 0.0 109.44 179.789 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.87 118.96 23.58 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.06 127.44 32.91 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.068 -1.053 . . . . 0.0 108.368 -179.769 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.463 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -82.82 134.02 35.12 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 179.568 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -76.78 145.66 38.38 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.414 ' N ' ' O ' ' A' ' 31' ' ' VAL . 14.3 t -137.57 105.85 3.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 CA-C-O 121.784 0.802 . . . . 0.0 110.036 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.499 ' NE2' ' OD1' ' A' ' 30' ' ' ASP . 23.7 m80 -82.5 103.53 12.11 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -73.72 120.18 22.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.511 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.3 p -80.35 -60.51 2.29 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.06 -1.025 . . . . 0.0 111.064 -177.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.435 ' N ' ' OG1' ' A' ' 25' ' ' THR . 14.0 t0 -50.04 -11.01 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.755 -1.215 . . . . 0.0 109.853 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.511 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.6 mt -119.13 -37.17 3.24 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 85.93 8.15 0.33 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 122.364 -0.21 . . . . 0.0 111.555 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -93.28 -175.75 3.92 Favored 'General case' 0 C--N 1.31 -1.112 0 O-C-N 120.487 -1.383 . . . . 0.0 109.236 179.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' NE2' ' A' ' 23' ' ' HIS . 20.6 m-20 -131.97 115.81 16.33 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.705 0.764 . . . . 0.0 109.125 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.414 ' O ' ' N ' ' A' ' 22' ' ' VAL . 35.7 t -109.21 157.2 9.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.5 131.84 40.31 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -113.8 113.08 24.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.617 -0.677 . . . . 0.0 109.291 -178.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.557 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 10.7 tpt180 -60.03 104.17 0.28 Allowed 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.28 -169.54 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 122.119 0.961 . . . . 0.0 110.89 -178.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.446 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.4 p -144.93 172.42 13.06 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.16 43.48 2.25 Favored Glycine 0 N--CA 1.483 1.804 0 N-CA-C 108.921 -1.672 . . . . 0.0 108.921 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.446 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.3 OUTLIER -142.39 3.61 1.53 Allowed 'General case' 0 N--CA 1.486 1.327 0 O-C-N 121.608 -0.936 . . . . 0.0 108.785 179.815 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.406 HG11 ' H ' ' A' ' 36' ' ' THR . 2.9 m -90.45 133.4 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.142 -0.974 . . . . 0.0 110.142 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.5 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.4 m-70 -76.24 144.2 40.51 Favored 'General case' 0 C--N 1.293 -1.867 0 O-C-N 120.814 -1.179 . . . . 0.0 108.579 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.457 ' C ' ' N ' ' A' ' 43' ' ' GLY . 82.5 mt -49.08 -51.53 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.992 -1.068 . . . . 0.0 109.101 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.55 -15.99 4.84 Favored Glycine 0 N--CA 1.484 1.847 0 N-CA-C 108.283 -1.927 . . . . 0.0 108.283 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.5 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -85.43 -25.85 38.06 Favored Glycine 0 N--CA 1.485 1.935 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 41' ' ' ILE . 38.5 t -81.44 -50.1 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.527 -0.984 . . . . 0.0 109.35 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -41.0 73.04 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.806 -1.184 . . . . 0.0 108.419 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tt -50.24 -58.56 5.34 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.239 -0.913 . . . . 0.0 109.174 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 48' ' ' LEU . 61.8 mttm -52.13 -54.54 29.36 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.468 -0.77 . . . . 0.0 110.561 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.417 ' C ' ' O ' ' A' ' 47' ' ' LYS . 4.0 mm? -45.67 -61.89 1.52 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.547 -1.346 . . . . 0.0 108.822 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 53' ' ' ASP . 97.4 t -52.69 -49.87 44.03 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 O-C-N 121.526 -0.733 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -46.3 -40.61 11.97 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.714 -1.241 . . . . 0.0 109.711 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -69.3 -57.63 5.06 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.322 -0.861 . . . . 0.0 110.325 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.2 tp -110.34 41.98 1.65 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.475 1.131 . . . . 0.0 109.56 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.626 ' N ' ' O ' ' A' ' 49' ' ' VAL . 36.4 t0 -52.08 -84.92 0.01 OUTLIER 'General case' 0 C--N 1.263 -3.186 0 CA-C-O 122.232 1.015 . . . . 0.0 109.291 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.534 ' O ' ' O ' ' A' ' 53' ' ' ASP . 14.1 p 43.14 179.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.277 -2.569 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.861 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.53 ' H ' ' CG2' ' A' ' 54' ' ' VAL . 0.7 OUTLIER -77.33 30.49 0.15 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.643 -1.286 . . . . 0.0 108.208 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.621 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 36.7 tttm -79.57 137.42 37.15 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.081 -1.048 . . . . 0.0 109.033 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -50.95 112.44 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.567 -0.708 . . . . 0.0 110.126 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.621 ' CH2' ' NZ ' ' A' ' 56' ' ' LYS . 12.7 m95 -127.44 -21.34 3.85 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.708 0.766 . . . . 0.0 109.788 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.2 t -40.05 -52.79 2.48 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.2 -0.938 . . . . 0.0 111.369 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.421 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 17.2 t0 -83.62 13.37 4.68 Favored 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.537 -0.727 . . . . 0.0 110.963 -178.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.62 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 3.6 p-80 -71.59 148.75 46.3 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 120.741 -1.224 . . . . 0.0 111.988 -178.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.98 155.22 5.5 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.558 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -93.93 148.46 22.13 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.532 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.25 151.52 48.61 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.333 -0.854 . . . . 0.0 108.913 -178.982 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -112.65 94.65 5.01 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.903 . . . . 0.0 108.639 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -55.77 -23.9 32.36 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.245 -0.909 . . . . 0.0 110.872 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.512 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -68.8 -9.03 48.69 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 178.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.56 -12.22 2.7 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.842 -178.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.1 mpp_? 52.43 45.77 27.91 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -113.37 -173.35 2.24 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.673 0.749 . . . . 0.0 110.143 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.32 101.64 7.06 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.721 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.435 ' N ' ' O ' ' A' ' 63' ' ' LEU . 34.4 mt -61.74 86.06 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.292 0 O-C-N 120.433 -1.417 . . . . 0.0 110.892 -176.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 8.74 11.39 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 76' ' ' HIS . 9.5 mmpt? -74.93 58.53 0.85 Allowed 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.1 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.82 -5.95 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.692 ' HD1' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -36.03 -63.44 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.883 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -130.78 -100.04 0.31 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.222 -0.924 . . . . 0.0 111.221 -178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.427 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -151.35 -164.38 1.98 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 119.671 -1.893 . . . . 0.0 111.365 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.532 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.1 mp -68.8 -57.79 5.09 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -42.35 -46.7 4.7 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.456 ' HZ1' ' CB ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -62.23 -28.93 70.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.487 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -85.79 -47.4 9.76 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.418 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 113.59 21.71 5.68 Favored Glycine 0 N--CA 1.499 2.854 0 N-CA-C 108.088 -2.005 . . . . 0.0 108.088 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 36.4 mt -82.53 161.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.877 -0.778 . . . . 0.0 109.907 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -167.76 -163.4 0.49 Allowed 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.37 -27.12 62.18 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.435 -0.791 . . . . 0.0 109.598 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.71 -14.46 62.46 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.463 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.32 113.93 26.51 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -94.67 118.85 32.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.015 -1.053 . . . . 0.0 109.577 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.4 mt -96.0 176.94 5.92 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.714 0.768 . . . . 0.0 109.675 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.532 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 10.0 mt-30 -131.13 165.56 23.02 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 58' ' ' TRP . 31.8 t80 -133.8 90.92 2.76 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.987 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.663 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.552 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m . . . . . 0 N--CA 1.488 1.474 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.84 135.21 57.71 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 120.774 -1.204 . . . . 0.0 110.39 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.72 103.82 13.32 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 178.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -50.8 127.05 17.42 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-O 122.14 0.972 . . . . 0.0 109.601 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.68 -34.56 5.4 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 106.043 -2.823 . . . . 0.0 106.043 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -106.04 -35.71 7.17 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.03 56.31 6.73 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 122.663 1.22 . . . . 0.0 109.968 -178.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -140.72 124.17 10.18 Favored Pre-proline 0 C--N 1.293 -1.855 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.4 135.14 9.14 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.452 1.197 . . . . 0.0 114.583 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.552 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.8 mt -93.64 98.49 8.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.4 p -99.52 91.36 4.87 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.29 -0.881 . . . . 0.0 111.313 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.63 -95.31 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.455 -2.258 . . . . 0.0 107.455 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.478 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.28 151.66 32.55 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.56 126.3 15.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.964 -1.085 . . . . 0.0 111.556 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 46.8 mt -91.29 146.86 5.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.702 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.3 m -117.41 147.06 43.02 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-O 121.888 0.851 . . . . 0.0 109.336 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.737 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.29 -129.17 0.26 Allowed 'General case' 0 C--N 1.295 -1.789 0 CA-C-O 121.499 0.666 . . . . 0.0 109.383 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.73 26.13 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.737 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.19 -9.03 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.89 163.56 22.17 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -106.1 174.25 5.97 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.14 138.11 9.96 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.33 -1.348 . . . . 0.0 109.813 -179.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.596 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.4 m80 -57.16 116.24 12.98 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 177.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.565 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 52.7 Cg_exo -45.13 -10.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.461 0 CA-C-N 120.311 1.147 . . . . 0.0 111.894 -178.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.596 ' N ' ' O ' ' B' ' 569' ' ' HIS . 12.4 mt-10 -100.06 -52.42 3.42 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.018 0.913 . . . . 0.0 110.042 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.486 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.5 m170 -58.01 -4.25 0.31 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.864 -1.147 . . . . 0.0 109.81 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.495 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.1 t80 -125.91 54.66 1.5 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . 0.402 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 16.4 m -93.9 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 CA-C-O 121.925 0.869 . . . . 0.0 110.616 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.453 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.29 143.6 31.19 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.626 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.47 74.76 3.29 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 116.672 -2.011 . . . . 0.0 109.84 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . 0.593 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 0.3 OUTLIER -153.65 -48.31 0.09 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 102.047 -3.316 . . . . 0.0 102.047 173.244 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.544 ' SG ' ' O ' ' B' ' 578' ' ' CYS . 29.5 p -132.0 81.52 1.97 Allowed 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 176.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.8 mt -53.1 15.65 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.47 -37.38 18.34 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 119.686 -1.884 . . . . 0.0 112.628 -178.255 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.565 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -160.3 140.72 11.69 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 119.596 -1.94 . . . . 0.0 114.448 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.453 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.6 tp -137.77 169.82 17.13 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.5 m-20 -146.22 133.58 20.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.27 -0.894 . . . . 0.0 109.429 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.702 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 2.7 ptpp? -55.38 -14.4 1.89 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.703 0.763 . . . . 0.0 109.518 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -92.9 -16.08 49.61 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -137.31 28.58 2.77 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 3.7 p90 -89.17 111.71 22.55 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 122.304 1.05 . . . . 0.0 109.814 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.56 167.12 10.0 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.873 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.439 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.6 tt0 -152.84 157.56 40.9 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.665 -1.272 . . . . 0.0 110.855 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.543 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.3 tp-100 -159.25 146.53 17.18 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 106.214 -1.773 . . . . 0.0 106.214 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.615 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.1 22.62 0.43 Allowed 'General case' 0 C--N 1.296 -1.726 0 O-C-N 120.954 -1.091 . . . . 0.0 109.505 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.472 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 80.72 -5.75 1.7 Allowed 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.718 -0.614 . . . . 0.0 110.849 178.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . 0.475 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 31.8 mttm -90.5 116.86 67.34 Favored Pre-proline 0 C--N 1.294 -1.824 0 O-C-N 121.22 -0.925 . . . . 0.0 109.483 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.527 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 36.0 Cg_exo -49.52 165.9 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.303 0 CA-C-N 120.026 1.045 . . . . 0.0 112.13 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 42.2 m-85 -170.13 138.68 1.7 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.24 -0.912 . . . . 0.0 109.776 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.3 m -69.57 152.84 44.3 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.343 -2.466 . . . . 0.0 104.343 174.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.423 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -57.0 -56.9 15.78 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -45.85 -30.61 1.76 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.462 -0.773 . . . . 0.0 109.731 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . 0.593 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 81.0 m -81.23 -60.96 2.09 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.262 -0.898 . . . . 0.0 108.806 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.583 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -57.42 -53.63 55.96 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.124 0.488 . . . . 0.0 110.187 -179.595 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.583 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -49.83 -43.47 48.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.981 -1.074 . . . . 0.0 109.108 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -55.77 -21.06 17.15 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.104 -0.997 . . . . 0.0 109.46 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 4.8 mt -91.92 -56.75 2.97 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.28 -0.887 . . . . 0.0 110.194 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -98.85 30.25 3.43 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.192 -0.943 . . . . 0.0 109.438 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.493 1.69 0 O-C-N 120.836 -1.165 . . . . 0.0 109.224 179.603 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.551 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.497 2.715 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.642 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 39.3 p -79.93 130.02 34.96 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.318 -1.107 . . . . 0.0 109.511 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.551 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -148.81 126.09 11.5 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.857 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.515 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -81.27 130.21 34.93 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.979 -1.076 . . . . 0.0 109.895 -179.68 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.47 133.03 34.49 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.46 142.67 39.04 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.017 -1.052 . . . . 0.0 108.595 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.8 t -136.25 109.93 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 CA-C-O 121.965 0.888 . . . . 0.0 109.992 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 9.4 m-70 -85.72 103.84 14.88 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.8 t -72.53 109.95 5.2 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.643 -1.223 . . . . 0.0 107.796 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.491 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -80.38 -39.29 28.69 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.166 -0.959 . . . . 0.0 109.588 -178.86 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 8.7 t0 -67.65 3.15 1.5 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.0 108.89 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.3 mt -139.63 -28.6 0.76 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.492 -0.755 . . . . 0.0 109.093 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.548 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 82.55 12.88 0.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 122.124 -0.36 . . . . 0.0 110.432 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.4 mtp-105 -94.87 -178.27 4.45 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.854 -1.154 . . . . 0.0 109.72 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 40.7 m-20 -138.38 115.98 11.35 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.5 t -117.16 157.69 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 CA-C-O 121.666 0.746 . . . . 0.0 110.145 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.18 130.32 38.99 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -116.73 115.88 26.47 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.642 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -61.37 138.48 58.25 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.417 ' CG1' ' O ' ' A' ' 34' ' ' ARG . 11.5 m -160.33 -169.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.438 0 CA-C-O 121.788 0.804 . . . . 0.0 109.241 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.502 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.7 p -145.18 165.13 29.23 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 178.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -74.16 43.93 1.3 Allowed Glycine 0 C--N 1.292 -1.887 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.8 OUTLIER -144.27 3.99 1.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.684 -0.892 . . . . 0.0 108.943 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.0 m -90.12 149.51 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.116 -0.99 . . . . 0.0 110.05 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -85.31 142.48 29.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.829 -1.17 . . . . 0.0 108.045 178.791 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.4 HD13 HG21 ' A' ' 41' ' ' ILE . 94.3 mt -47.77 -54.9 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.081 -1.012 . . . . 0.0 109.041 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.2 -17.04 10.03 Favored Glycine 0 N--CA 1.484 1.882 0 N-CA-C 108.224 -1.95 . . . . 0.0 108.224 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -70.84 -29.31 69.45 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.319 -1.912 . . . . 0.0 108.319 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.26 -36.36 12.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.1 mtm -51.29 -37.02 45.21 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.7 tp -69.89 -65.95 0.65 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.461 0.648 . . . . 0.0 110.66 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.415 ' NZ ' ' O ' ' A' ' 43' ' ' GLY . 29.9 mtmm -53.81 -55.7 24.17 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.41 -0.806 . . . . 0.0 111.467 -178.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.2 tp -45.98 -48.67 16.5 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.875 -1.14 . . . . 0.0 109.958 -179.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.9 t -67.8 -46.1 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.972 -1.08 . . . . 0.0 109.633 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -45.28 -38.43 5.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.284 -0.885 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -66.59 -44.69 81.48 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.369 -0.832 . . . . 0.0 109.992 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -60.13 -65.18 0.72 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.011 -1.056 . . . . 0.0 108.361 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.5 t70 76.44 80.83 0.09 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.964 0.887 . . . . 0.0 110.561 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.529 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.32 140.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -69.18 35.67 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.376 -0.827 . . . . 0.0 109.946 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' A' ' 54' ' ' VAL . 11.6 ttmm -78.44 147.12 34.12 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.989 -1.07 . . . . 0.0 109.024 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.522 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -61.86 107.03 0.77 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.537 -0.727 . . . . 0.0 109.377 179.805 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.511 ' O ' ' N ' ' A' ' 61' ' ' HIS . 75.8 m95 -106.42 -35.12 7.2 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.373 -0.83 . . . . 0.0 110.224 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.405 ' C ' ' O ' ' A' ' 58' ' ' TRP . 1.5 t -41.57 -51.21 3.99 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.457 -0.777 . . . . 0.0 109.826 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -56.6 -37.73 71.06 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.522 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 11.1 m-70 -72.64 134.79 45.28 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-O 121.649 0.738 . . . . 0.0 109.849 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -145.95 174.83 10.92 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 2.1 mm? -94.54 141.02 29.08 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.885 -1.134 . . . . 0.0 109.978 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.497 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -125.32 151.12 46.46 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.674 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.541 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.03 93.64 4.58 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.041 -1.037 . . . . 0.0 108.652 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -54.72 -24.21 21.11 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.179 -0.951 . . . . 0.0 111.043 -179.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.51 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -67.97 -9.44 45.43 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -133.78 -12.53 2.61 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.955 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 52.49 45.74 28.0 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.0 t -112.13 -171.49 1.86 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.393 0.616 . . . . 0.0 109.697 -178.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.544 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.89 99.14 5.4 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 177.147 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -60.3 83.94 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 122.594 1.188 . . . . 0.0 110.608 -176.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.4 pp -118.97 6.97 11.36 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 178.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.512 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -83.63 57.31 4.01 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.4 m -49.71 -11.65 0.06 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.056 -1.028 . . . . 0.0 109.126 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.512 ' H ' ' C ' ' A' ' 74' ' ' LYS . 41.1 m80 -64.45 150.06 47.28 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.404 -0.81 . . . . 0.0 109.786 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 78.8 m95 54.98 -129.26 2.16 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.756 -0.59 . . . . 0.0 110.319 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -156.24 -163.66 1.51 Allowed 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 118.262 -1.375 . . . . 0.0 112.886 -177.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.522 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.3 mp -69.03 -56.06 8.92 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -44.82 -46.29 10.6 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.731 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.496 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -58.3 -31.24 67.31 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.768 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.496 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -85.11 -46.23 11.32 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.13 14.32 7.19 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 108.631 -1.787 . . . . 0.0 108.631 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.538 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 35.8 mt -72.61 161.53 4.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.726 -0.867 . . . . 0.0 109.902 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.38 -171.97 1.18 Allowed 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.45 -20.02 65.44 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 109.993 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.506 ' OD2' ' N ' ' A' ' 88' ' ' ALA . 46.0 p-10 -79.92 -21.0 44.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.506 ' N ' ' OD2' ' A' ' 87' ' ' ASP . . . -103.47 112.39 25.27 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -98.41 174.5 6.44 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.035 -1.04 . . . . 0.0 110.317 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.3 mt -138.13 179.69 6.3 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.913 0.863 . . . . 0.0 109.368 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.482 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.3 mt-30 -129.81 168.55 16.39 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -131.39 99.5 4.85 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.729 -176.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.541 ' H ' ' H ' ' B' ' 556' ' ' ILE . 2.4 m . . . . . 0 N--CA 1.487 1.408 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.8 mp -56.35 134.97 53.97 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 120.818 -1.176 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -84.61 104.26 14.44 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 178.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.3 t -49.38 126.08 12.41 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 122.139 0.971 . . . . 0.0 109.89 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.18 -35.95 4.63 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 106.381 -2.688 . . . . 0.0 106.381 -177.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.8 m -103.53 -35.99 8.12 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.42 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 55.25 56.07 6.83 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.819 1.295 . . . . 0.0 109.861 -178.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -140.94 124.1 9.93 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -43.57 134.73 7.07 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 CA-C-N 120.461 1.2 . . . . 0.0 114.956 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.541 ' H ' ' H ' ' B' ' 547' ' ' SER . 41.2 mt -92.88 98.3 8.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' B' ' 557' ' ' THR . 7.4 p -98.48 92.54 5.7 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.196 -0.94 . . . . 0.0 111.398 -177.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.56 -96.26 0.16 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 107.421 -2.271 . . . . 0.0 107.421 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.467 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 7.2 mmt180 -114.88 153.09 31.12 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 177.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -144.49 126.79 15.77 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.923 -1.111 . . . . 0.0 111.373 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.3 mt -90.38 146.05 6.67 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 10.1 m -121.71 146.28 47.18 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 122.008 0.908 . . . . 0.0 109.018 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.762 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.27 -128.73 0.27 Allowed 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.546 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.6 mtt -66.0 26.19 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.531 -0.731 . . . . 0.0 109.081 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.762 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.08 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.46 147.78 28.53 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -94.46 174.59 7.05 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.212 -0.93 . . . . 0.0 108.556 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.9 136.49 7.99 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.767 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.579 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -56.84 116.29 12.78 Favored Pre-proline 0 C--N 1.3 -1.575 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 39.1 Cg_exo -46.67 -10.2 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.471 0 CA-C-N 120.359 1.164 . . . . 0.0 111.399 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' B' ' 569' ' ' HIS . 14.0 mt-10 -98.07 -52.08 3.82 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 122.019 0.914 . . . . 0.0 110.066 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.497 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 20.4 m170 -58.64 -4.17 0.39 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 120.949 -1.094 . . . . 0.0 109.764 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.485 ' H ' ' C ' ' B' ' 571' ' ' GLU . 17.0 t80 -128.09 58.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . 0.402 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.31 177.45 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.709 0.766 . . . . 0.0 111.359 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.471 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.48 147.36 35.92 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.84 74.35 3.58 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 116.595 -2.042 . . . . 0.0 110.033 179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -154.14 -65.61 0.14 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 102.436 -3.172 . . . . 0.0 102.436 172.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -111.04 82.06 1.53 Allowed 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.296 -2.229 . . . . 0.0 105.238 177.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . 0.597 ' CD1' ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.0 15.4 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -176.677 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.5 -36.66 16.3 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 119.595 -1.941 . . . . 0.0 113.016 -178.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.4 tp60 -159.76 139.8 11.7 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 119.359 -2.088 . . . . 0.0 115.179 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.471 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.1 tp -139.53 168.7 19.22 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.2 m-20 -150.2 133.53 16.41 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.156 -0.965 . . . . 0.0 109.264 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 9.0 ptpt -51.3 -18.11 0.89 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.482 -0.761 . . . . 0.0 109.432 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -19.32 53.11 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 -179.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 586' ' ' THR . . . . . 0.404 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.7 p -134.31 25.58 3.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.559 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.6 109.87 21.02 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.339 1.066 . . . . 0.0 109.897 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.18 159.28 15.68 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 179.647 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.6 tt0 -154.39 156.94 37.77 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.624 1.202 . . . . 0.0 111.147 -178.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.438 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 2.4 pt20 -157.25 145.79 19.57 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.677 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.47 23.82 0.65 Allowed 'General case' 0 C--N 1.289 -2.033 0 O-C-N 121.318 -0.864 . . . . 0.0 109.277 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 83.41 -7.91 1.12 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.915 -0.491 . . . . 0.0 111.958 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -85.72 115.82 63.16 Favored Pre-proline 0 C--N 1.296 -1.738 0 O-C-N 120.966 -1.084 . . . . 0.0 110.763 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 29.1 Cg_exo -53.99 161.92 4.45 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 CA-C-N 120.018 1.042 . . . . 0.0 112.436 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.2 m-85 -171.47 141.68 1.56 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.473 -0.767 . . . . 0.0 109.621 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.0 m -71.21 154.58 41.56 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 104.434 -2.432 . . . . 0.0 104.434 174.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.464 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.03 -55.32 36.48 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.76 -27.89 1.35 Allowed 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.648 -0.657 . . . . 0.0 109.47 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 52.4 m -85.27 -56.99 3.26 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 2.3 t80 -57.93 -54.23 49.32 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.46 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.06 -39.58 56.33 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.0 108.549 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.69 -30.75 56.59 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.533 -0.73 . . . . 0.0 110.036 -179.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.36 -57.48 2.49 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.246 -0.909 . . . . 0.0 111.761 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.51 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 5.7 m-85 -88.81 24.58 2.0 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.106 -0.996 . . . . 0.0 110.517 -178.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.51 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 2.3 m . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.029 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.443 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.1 p -79.19 122.63 26.52 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.622 -0.928 . . . . 0.0 110.218 -179.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.443 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -132.85 122.25 24.14 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.53 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.66 134.72 40.51 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.498 -179.275 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.49 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.66 131.24 34.96 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.244 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -77.57 145.45 36.85 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.069 -1.019 . . . . 0.0 108.589 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.0 t -139.58 130.63 32.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.445 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 43.5 m80 -105.76 103.99 13.61 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.52 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.1 t -75.06 115.51 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 118.514 -1.274 . . . . 0.0 108.668 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.37 -43.02 21.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.323 -0.861 . . . . 0.0 110.227 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 3.2 p-10 -64.26 -11.33 30.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.929 -1.107 . . . . 0.0 109.48 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -122.6 -24.16 4.98 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.542 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 73.03 13.29 4.9 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 -177.638 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.3 mtp180 -89.02 -177.11 5.38 Favored 'General case' 0 C--N 1.307 -1.264 0 O-C-N 121.195 -0.941 . . . . 0.0 109.455 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.445 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 0.8 OUTLIER -138.45 118.46 13.39 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 178.022 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.3 t -118.41 155.93 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.716 0.77 . . . . 0.0 110.486 -178.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.66 131.12 39.16 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.111 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -114.78 112.94 23.57 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.53 -0.732 . . . . 0.0 109.981 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -60.98 104.99 0.42 Allowed 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.5 m -136.0 -169.12 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 121.857 0.837 . . . . 0.0 110.099 -178.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.413 ' C ' ' H ' ' A' ' 38' ' ' GLU . 4.1 p -142.62 171.16 14.43 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.25 47.1 2.86 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 108.585 -1.806 . . . . 0.0 108.585 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.413 ' H ' ' C ' ' A' ' 36' ' ' THR . 1.0 OUTLIER -146.04 0.25 0.82 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.687 -0.89 . . . . 0.0 108.955 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 m -90.2 145.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.179 -0.951 . . . . 0.0 109.447 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.534 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -78.91 133.65 36.92 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 177.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -36.45 29.03 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 O-C-N 120.546 -1.347 . . . . 0.0 108.022 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.09 -22.37 49.06 Favored Glycine 0 N--CA 1.484 1.861 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.42 -22.94 78.68 Favored Glycine 0 C--O 1.209 -1.463 0 N-CA-C 108.016 -2.033 . . . . 0.0 108.016 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.19 -33.85 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 61' ' ' HIS . 32.6 mtm -51.97 -39.19 58.93 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.11 -59.97 2.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.746 -0.596 . . . . 0.0 111.457 -178.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -46.37 -56.06 6.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.812 -1.18 . . . . 0.0 110.112 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -46.52 -60.94 2.05 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.02 -1.05 . . . . 0.0 109.76 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 53.1 t -53.25 -47.78 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 120.969 -1.082 . . . . 0.0 110.056 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -45.51 -42.98 11.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.133 -0.979 . . . . 0.0 109.816 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -62.94 -43.02 99.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.374 -0.829 . . . . 0.0 110.162 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.441 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -62.0 -66.72 0.5 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.515 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.87 82.57 0.1 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.994 0.902 . . . . 0.0 110.119 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.56 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.2 p -171.41 141.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.571 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.51 ' HZ2' ' CG2' ' B' ' 574' ' ' VAL . 25.7 tptt -67.43 32.68 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.427 -0.795 . . . . 0.0 109.671 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.614 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 20.1 ttpp -78.76 139.71 38.38 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.849 -1.157 . . . . 0.0 109.552 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -49.96 118.42 2.89 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.381 -0.824 . . . . 0.0 109.352 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.63 ' O ' ' CG ' ' A' ' 61' ' ' HIS . 61.2 m95 -118.94 -23.62 6.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.484 -0.76 . . . . 0.0 110.431 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.456 ' C ' ' H ' ' A' ' 61' ' ' HIS . 0.3 OUTLIER -44.85 -54.35 6.51 Favored 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.678 -1.264 . . . . 0.0 110.122 -179.206 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 49.0 t0 -59.8 -2.96 0.44 Allowed 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.436 -0.79 . . . . 0.0 110.076 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.63 ' CG ' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -75.12 149.53 39.05 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 -179.446 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -171.32 151.16 3.04 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.6 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -94.65 144.6 25.48 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.49 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.7 143.01 50.84 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.544 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -103.96 91.01 3.79 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.054 -1.029 . . . . 0.0 108.668 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.409 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.62 -22.62 14.04 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.227 -0.92 . . . . 0.0 111.205 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.46 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -64.43 -21.77 66.75 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 178.312 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.525 ' C ' HH21 ' A' ' 69' ' ' ARG . 15.3 mmtt -120.67 -12.09 8.93 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.38 -178.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.544 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.0 OUTLIER 52.9 46.53 26.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.006 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.58 -174.14 2.41 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.409 0.623 . . . . 0.0 110.125 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.527 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.57 98.39 5.01 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 177.385 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.18 92.31 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 123.04 1.4 . . . . 0.0 110.121 -176.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -125.71 6.21 7.46 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.006 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -82.59 39.83 0.63 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 p -46.26 -15.11 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.078 -1.014 . . . . 0.0 110.127 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 7.9 m80 -79.27 43.42 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.154 -0.966 . . . . 0.0 110.253 -179.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -176.86 -142.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.025 -1.047 . . . . 0.0 108.573 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.58 166.34 32.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 119.736 -1.853 . . . . 0.0 111.261 -178.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.461 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.5 mp -44.76 -59.02 2.72 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -45.64 -36.85 5.13 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.157 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.517 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -62.85 -35.71 80.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.031 -1.068 . . . . 0.0 108.573 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.517 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -92.71 -38.84 11.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.016 -1.053 . . . . 0.0 108.426 178.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.85 12.63 8.38 Favored Glycine 0 N--CA 1.5 2.912 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.545 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 68.1 mt -61.04 156.61 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.433 -1.04 . . . . 0.0 108.519 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.545 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.77 -174.81 1.66 Allowed 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.74 -25.13 66.25 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.374 -0.829 . . . . 0.0 109.803 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -81.14 -6.08 58.42 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.36 112.82 24.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.691 -0.631 . . . . 0.0 109.451 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.0 mmtp -97.66 116.25 29.51 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.117 -0.989 . . . . 0.0 109.255 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.6 mt -99.62 177.81 5.04 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.627 0.727 . . . . 0.0 109.698 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.49 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 7.6 mt-30 -129.84 167.02 18.78 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -133.49 95.62 3.54 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.217 0 O-C-N 121.944 -0.472 . . . . 0.0 111.275 -176.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.524 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.6 m . . . . . 0 N--CA 1.488 1.464 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -61.36 135.82 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.021 -1.049 . . . . 0.0 110.346 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.32 103.51 12.76 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.7 t -50.8 126.54 16.12 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 122.144 0.974 . . . . 0.0 109.527 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.12 5.63 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 106.301 -2.719 . . . . 0.0 106.301 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -106.45 -35.44 7.1 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.413 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.28 56.63 6.21 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 122.659 1.219 . . . . 0.0 109.972 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -140.6 123.55 9.99 Favored Pre-proline 0 C--N 1.294 -1.845 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -44.41 135.81 8.86 Favored 'Trans proline' 0 N--CA 1.494 1.502 0 CA-C-N 120.509 1.217 . . . . 0.0 114.58 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.524 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -95.19 98.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.407 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.8 p -100.91 91.26 4.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.212 -0.93 . . . . 0.0 111.211 -178.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.76 -95.21 0.14 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.356 -2.298 . . . . 0.0 107.356 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.6 mmt-85 -113.4 150.25 32.97 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.4 p -144.71 126.41 15.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.971 -1.081 . . . . 0.0 111.509 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.34 146.74 5.87 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.8 m -118.48 146.63 44.35 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.761 0.791 . . . . 0.0 108.934 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.722 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.17 -129.39 0.26 Allowed 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 121.604 0.716 . . . . 0.0 109.352 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.564 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.8 mtt -65.97 26.42 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.722 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.42 -9.04 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 -178.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.1 mtmt -82.17 162.73 22.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt -105.62 174.52 5.85 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -161.21 136.25 7.52 Favored 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.969 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -55.49 114.7 7.74 Favored Pre-proline 0 C--N 1.301 -1.531 0 N-CA-C 105.525 -2.028 . . . . 0.0 105.525 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.605 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 45.2 Cg_exo -45.67 -12.84 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.527 0 CA-C-N 120.237 1.12 . . . . 0.0 111.408 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' B' ' 569' ' ' HIS . 11.0 mt-10 -95.73 -52.71 3.98 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.988 0.899 . . . . 0.0 110.252 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.519 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.2 m170 -58.35 -4.0 0.33 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.986 -1.071 . . . . 0.0 109.876 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.498 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.4 t80 -128.93 56.35 1.68 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 178.415 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . 0.51 ' CG2' ' HZ2' ' A' ' 55' ' ' LYS . 17.1 m -94.0 178.02 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.814 0.816 . . . . 0.0 110.898 -178.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.446 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.41 143.82 30.03 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.74 73.61 5.79 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.505 -2.078 . . . . 0.0 108.905 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . 0.414 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 34.9 t80 -154.56 -60.13 0.12 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 102.858 -3.016 . . . . 0.0 102.858 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' B' ' 580' ' ' LYS . 31.9 p -113.96 79.12 1.21 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.534 -2.121 . . . . 0.0 105.413 176.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 5.9 mt -51.36 14.7 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.019 -0.992 . . . . 0.0 113.272 -176.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -97.11 -36.84 10.35 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.045 -1.66 . . . . 0.0 112.652 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.605 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.18 140.93 13.38 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 119.617 -1.927 . . . . 0.0 114.636 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.446 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 23.2 tp -134.51 169.97 16.47 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.427 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.5 m-20 -145.49 128.16 16.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.335 -0.853 . . . . 0.0 109.073 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -51.2 -21.53 2.09 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.57 -0.707 . . . . 0.0 109.689 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.12 -19.81 60.25 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.56 28.46 3.97 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.569 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.07 105.72 17.97 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 122.932 1.349 . . . . 0.0 110.088 -179.634 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.528 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -97.51 167.76 10.79 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.5 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.8 tt0 -152.61 157.37 40.9 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.558 1.17 . . . . 0.0 110.711 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.629 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.9 OUTLIER -155.35 146.04 22.23 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 178.773 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.578 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 45.86 23.51 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.012 -1.055 . . . . 0.0 109.991 -179.701 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.68 -5.11 1.55 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.715 -0.615 . . . . 0.0 111.078 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 32.6 mttm -89.61 123.17 67.26 Favored Pre-proline 0 C--N 1.295 -1.8 0 O-C-N 121.161 -0.962 . . . . 0.0 109.241 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.486 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.8 Cg_exo -48.63 163.94 0.25 Allowed 'Trans proline' 0 N--CA 1.489 1.243 0 CA-C-N 120.051 1.054 . . . . 0.0 111.941 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' B' ' 588' ' ' LYS . 11.3 m-85 -170.34 138.43 1.58 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.017 -1.052 . . . . 0.0 110.685 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 39.5 m -75.38 157.39 34.27 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 174.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.476 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.03 -56.69 18.01 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 117.53 -1.668 . . . . 0.0 106.618 178.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.17 -27.29 0.94 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.582 -0.698 . . . . 0.0 109.552 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 87.9 m -85.06 -59.28 2.38 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.484 -0.76 . . . . 0.0 109.01 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -54.69 -49.48 70.56 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.477 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -55.73 -40.27 72.25 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.14 -28.32 10.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.756 . . . . 0.0 109.52 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.08 -57.48 2.52 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.233 -0.917 . . . . 0.0 112.051 -176.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.629 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 14.6 m-85 -92.23 22.12 4.69 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.809 -1.182 . . . . 0.0 110.598 -178.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.52 ' O ' ' CE1' ' A' ' 76' ' ' HIS . 2.2 m . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.109 -0.995 . . . . 0.0 108.952 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.441 0 N-CA-C 108.648 -1.781 . . . . 0.0 108.648 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.453 ' H ' ' HG1' ' A' ' 17' ' ' THR . 6.1 p -97.91 122.07 40.58 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.661 -0.905 . . . . 0.0 109.771 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -127.92 130.11 47.94 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.484 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.528 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -82.98 135.72 34.78 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.189 -0.944 . . . . 0.0 110.013 -179.358 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.48 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.72 131.33 34.58 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.98 144.55 36.65 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 120.9 -1.125 . . . . 0.0 108.326 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.8 t -139.18 108.58 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.749 0.785 . . . . 0.0 110.314 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 14.0 m80 -82.49 105.98 13.99 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.537 ' O ' ' N ' ' A' ' 28' ' ' ASN . 5.4 t -73.45 111.18 7.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 118.807 -1.157 . . . . 0.0 109.607 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.541 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.1 p -76.87 165.58 24.5 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.8 t70 72.81 -44.57 0.6 Allowed 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.541 ' H ' ' C ' ' A' ' 25' ' ' THR . 5.7 mt -94.25 -31.37 14.12 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 70.93 17.6 6.25 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.804 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -89.13 -179.59 5.93 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.698 -1.251 . . . . 0.0 108.872 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 3.1 m-20 -139.91 115.41 9.99 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.3 t -115.25 157.41 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 CA-C-O 121.536 0.684 . . . . 0.0 109.966 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.13 132.76 42.03 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -115.53 112.91 22.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.636 -0.665 . . . . 0.0 110.372 -178.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.65 109.1 0.95 Allowed 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.53 -169.27 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 CA-C-O 121.815 0.817 . . . . 0.0 110.218 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.7 p -143.64 174.55 10.69 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.73 44.01 3.04 Favored Glycine 0 N--CA 1.483 1.801 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -145.37 3.82 1.02 Allowed 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.16 143.3 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 120.92 -1.113 . . . . 0.0 110.072 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.511 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -80.16 141.83 35.33 Favored 'General case' 0 C--N 1.293 -1.881 0 O-C-N 120.888 -1.133 . . . . 0.0 108.126 178.794 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.479 ' C ' ' H ' ' A' ' 43' ' ' GLY . 19.6 mt -47.27 -58.32 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.047 -1.033 . . . . 0.0 109.495 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.38 -13.59 4.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.023 -2.031 . . . . 0.0 108.023 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.6 -28.47 67.36 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.95 -35.58 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.7 mtm -51.02 -37.72 46.91 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.32 -63.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.836 -0.54 . . . . 0.0 109.843 -179.192 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 32.8 mttt -53.34 -56.54 15.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.942 . . . . 0.0 111.37 -178.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.6 tp -45.46 -34.15 3.03 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.846 -1.159 . . . . 0.0 110.215 -177.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 19.4 t -80.46 -44.12 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.985 -1.072 . . . . 0.0 109.114 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -43.11 -33.89 0.96 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.527 0.679 . . . . 0.0 109.969 -178.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mtmt -83.72 -39.76 19.73 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.539 -0.726 . . . . 0.0 110.43 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.9 tp -51.23 -60.58 2.96 Favored 'General case' 0 N--CA 1.484 1.249 0 O-C-N 121.133 -0.979 . . . . 0.0 108.969 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 68.73 78.83 0.22 Allowed 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.861 0.838 . . . . 0.0 110.424 178.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.548 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -173.78 142.07 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.463 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.1 tttt -71.28 39.81 0.06 Allowed 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.554 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.548 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.7 ttmm -77.47 154.15 32.84 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.53 91.2 7.36 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 0.1 OUTLIER -80.59 -44.17 19.39 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 122.129 0.966 . . . . 0.0 109.015 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.533 ' C ' ' H ' ' A' ' 61' ' ' HIS . 58.4 p -39.82 -55.31 1.99 Allowed 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.166 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -52.41 -8.05 0.07 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.191 -0.943 . . . . 0.0 109.517 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.7 OUTLIER -98.27 173.32 7.05 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 122.319 1.057 . . . . 0.0 110.771 -179.233 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' CD2' ' A' ' 61' ' ' HIS . . . -168.19 162.18 12.73 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.4 mm? -94.75 145.9 24.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.182 -0.949 . . . . 0.0 109.347 -179.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.464 ' NE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.11 148.53 50.58 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -106.08 91.07 3.57 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.056 -1.027 . . . . 0.0 108.527 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.64 -21.77 19.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.064 -1.023 . . . . 0.0 111.037 -178.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.499 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -66.07 -17.73 64.89 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' N ' ' O ' ' A' ' 65' ' ' TRP . 19.0 mmtt -125.97 -11.92 6.49 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.623 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.0 mpp_? 53.69 46.41 25.97 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 -177.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.582 ' HG1' ' H ' ' A' ' 71' ' ' TRP . 5.3 t -113.03 -171.62 1.9 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.365 0.602 . . . . 0.0 109.851 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.582 ' H ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -128.34 99.46 5.43 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.496 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -60.36 82.28 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.926 0 CA-C-O 122.372 1.082 . . . . 0.0 110.673 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -118.33 5.74 11.86 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.48 55.54 2.32 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.6 m -47.77 -25.06 1.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.047 -1.033 . . . . 0.0 109.218 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.1 158.32 13.99 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.487 -0.758 . . . . 0.0 109.461 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 45.1 m95 57.34 -138.16 0.94 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.662 -0.649 . . . . 0.0 110.05 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.63 -162.8 1.38 Allowed 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.527 -1.269 . . . . 0.0 111.583 -179.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.536 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.6 mp -72.46 -56.34 5.57 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -43.02 -49.41 6.07 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.629 -1.168 . . . . 0.0 111.188 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -56.63 -30.6 63.47 Favored 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.475 -178.3 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.519 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -82.88 -49.0 10.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.848 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 118.11 7.83 11.05 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.161 -1.976 . . . . 0.0 108.161 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.544 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 30.3 mt -60.66 161.36 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.544 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -155.75 -163.06 1.42 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.962 -1.086 . . . . 0.0 109.64 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.88 -24.18 59.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.49 -0.756 . . . . 0.0 110.75 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -84.77 3.17 38.81 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.43 -0.794 . . . . 0.0 109.756 -178.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.48 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -91.72 112.68 24.7 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.543 -0.723 . . . . 0.0 109.332 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -97.78 117.87 33.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.92 -1.113 . . . . 0.0 109.894 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.6 178.01 4.68 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.464 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.7 mt-30 -131.52 157.92 42.28 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -122.79 93.4 3.95 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.817 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.229 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.361 -178.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.538 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.26 136.17 57.95 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.627 -1.296 . . . . 0.0 110.474 -178.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . 0.445 ' O ' ' N ' ' B' ' 553' ' ' GLN . 0.4 OUTLIER -83.89 103.51 13.22 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 178.094 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.4 t -52.11 128.83 25.89 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 122.315 1.055 . . . . 0.0 110.872 -176.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.71 -25.43 28.34 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 106.433 -2.667 . . . . 0.0 106.433 -178.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . 0.427 ' CB ' ' SG ' ' B' ' 549' ' ' CYS . 2.0 t -112.78 -29.99 7.22 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' B' ' 549' ' ' CYS . 17.3 mm-40 46.88 57.46 5.61 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 122.525 1.155 . . . . 0.0 112.779 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -142.51 125.92 9.47 Favored Pre-proline 0 C--N 1.286 -2.184 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -44.34 134.94 9.05 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 CA-C-N 120.412 1.183 . . . . 0.0 114.596 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.4 mt -94.37 98.04 7.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.42 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.3 p -100.54 90.94 4.45 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.273 -0.892 . . . . 0.0 111.194 -177.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.11 -96.33 0.16 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.483 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.0 mmt-85 -110.83 150.54 29.0 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 178.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.73 126.26 15.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 111.677 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.27 146.49 6.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 178.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.9 m -119.93 146.45 45.79 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.803 0.811 . . . . 0.0 109.02 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.718 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.21 -129.29 0.27 Allowed 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.517 0.675 . . . . 0.0 109.538 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.56 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 13.7 mtm -66.09 26.57 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.718 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.62 -9.38 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . 0.457 ' HZ1' ' CE ' ' B' ' 564' ' ' MET . 13.1 mtmt -81.53 161.14 23.7 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -103.29 174.4 5.88 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.11 134.9 7.74 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.207 -1.397 . . . . 0.0 109.911 -179.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.556 ' O ' ' N ' ' B' ' 571' ' ' GLU . 4.4 m80 -55.84 114.9 8.28 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 176.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.601 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.22 -12.49 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.534 0 CA-C-N 120.47 1.204 . . . . 0.0 110.703 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' B' ' 569' ' ' HIS . 5.5 mt-10 -94.57 -52.46 4.3 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.046 0.927 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.534 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -60.67 -3.67 0.77 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.958 -1.089 . . . . 0.0 109.812 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.474 ' H ' ' C ' ' B' ' 571' ' ' GLU . 25.5 t80 -128.84 55.78 1.7 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 15.4 m -94.52 178.2 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-O 121.85 0.833 . . . . 0.0 111.24 -178.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.445 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.8 142.59 30.54 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.76 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -92.6 75.22 5.07 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 116.717 -1.993 . . . . 0.0 109.289 178.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -153.05 -51.58 0.1 Allowed 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 102.413 -3.18 . . . . 0.0 102.413 173.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.553 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.1 p -129.64 80.53 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.94 -2.391 . . . . 0.0 105.299 177.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.85 15.1 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -176.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.553 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.99 -37.22 16.54 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 119.733 -1.854 . . . . 0.0 112.112 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.601 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -160.13 139.82 11.23 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 119.624 -1.923 . . . . 0.0 114.907 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.445 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.8 tp -135.81 169.35 17.7 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 71.2 m-20 -142.53 143.34 32.46 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.333 -0.855 . . . . 0.0 108.891 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -64.14 -17.24 63.28 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.478 -0.763 . . . . 0.0 109.773 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.59 -17.14 55.56 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.08 27.14 4.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.933 -0.745 . . . . 0.0 109.363 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.517 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -88.72 111.24 21.74 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.593 1.187 . . . . 0.0 109.331 179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.514 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.76 168.89 8.95 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.8 tt0 -151.84 157.07 41.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.729 -1.232 . . . . 0.0 110.797 -178.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.539 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 2.5 tp60 -158.59 146.45 18.12 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 178.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.622 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.24 22.56 0.45 Allowed 'General case' 0 C--N 1.295 -1.783 0 O-C-N 120.911 -1.118 . . . . 0.0 109.547 -179.434 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 0.8 OUTLIER 79.44 -3.69 2.08 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.732 -0.605 . . . . 0.0 110.933 178.519 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -91.03 125.44 58.74 Favored Pre-proline 0 C--N 1.294 -1.81 0 O-C-N 121.265 -0.897 . . . . 0.0 109.39 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.6 Cg_exo -48.87 165.77 0.17 Allowed 'Trans proline' 0 N--CA 1.492 1.404 0 CA-C-N 120.15 1.089 . . . . 0.0 111.955 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.0 m-85 -171.1 136.89 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.9 -1.125 . . . . 0.0 111.066 -178.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 23.3 m -73.05 154.55 40.4 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.446 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.77 -58.14 9.85 Favored 'General case' 0 C--N 1.288 -2.081 0 C-N-CA 117.525 -1.67 . . . . 0.0 106.582 179.28 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -46.04 -26.17 0.69 Allowed 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -85.36 -64.48 1.15 Allowed 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.533 -0.73 . . . . 0.0 109.389 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -50.98 -53.56 32.06 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.847 . . . . 0.0 108.856 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.557 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -50.51 -41.87 54.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.38 -24.42 12.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.452 -0.78 . . . . 0.0 109.087 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 3.6 mt -94.16 -56.97 2.66 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.281 -0.887 . . . . 0.0 111.5 -178.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.515 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 51.7 m-85 -105.1 -28.49 10.98 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.136 -0.978 . . . . 0.0 110.953 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.2 p . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.949 -179.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.574 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -76.92 126.55 31.16 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.416 -1.05 . . . . 0.0 110.379 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.4 ' CD2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -130.68 119.76 22.88 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 177.89 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.533 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.9 127.83 33.9 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.11 -1.036 . . . . 0.0 109.008 -179.375 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.5 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.3 OUTLIER -83.52 134.3 34.84 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 179.447 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 t -78.21 145.68 35.4 Favored 'General case' 0 C--N 1.294 -1.822 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.433 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.5 t -136.81 105.3 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 CA-C-O 121.817 0.817 . . . . 0.0 109.525 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.53 ' CD2' ' OD2' ' A' ' 30' ' ' ASP . 12.1 m80 -78.79 103.71 8.92 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 178.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.5 t -72.28 113.3 9.23 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 118.613 -1.235 . . . . 0.0 107.972 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.532 ' HG1' ' N ' ' A' ' 26' ' ' ASP . 30.3 p -80.84 -36.94 30.83 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.392 -0.817 . . . . 0.0 109.873 -178.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.532 ' N ' ' HG1' ' A' ' 25' ' ' THR . 4.6 m-20 -71.34 9.55 0.77 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.946 -1.096 . . . . 0.0 108.654 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.521 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.9 mt -147.06 -29.07 0.37 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.585 -0.697 . . . . 0.0 109.294 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 80.78 12.5 0.84 Allowed 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -179.424 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -94.29 -178.26 4.54 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.997 -1.065 . . . . 0.0 109.495 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.53 ' OD2' ' CD2' ' A' ' 23' ' ' HIS . 3.5 m-20 -136.0 114.99 12.24 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.8 t -112.35 157.59 13.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.46 133.99 44.53 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -113.76 113.01 24.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.645 -0.659 . . . . 0.0 109.695 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.574 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 14.7 tpt180 -60.12 102.38 0.16 Allowed 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 23.8 m -132.96 -169.75 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 CA-C-O 121.918 0.866 . . . . 0.0 110.854 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.3 p -145.26 176.43 9.55 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.33 46.58 3.04 Favored Glycine 0 C--N 1.295 -1.729 0 N-CA-C 109.153 -1.579 . . . . 0.0 109.153 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -147.01 0.23 0.72 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.203 -1.175 . . . . 0.0 108.669 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 m -89.76 128.21 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 120.97 -1.081 . . . . 0.0 109.691 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 43' ' ' GLY . 7.6 m80 -66.92 144.15 56.41 Favored 'General case' 0 C--N 1.291 -1.957 0 O-C-N 121.001 -1.062 . . . . 0.0 108.887 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.4 mt -46.22 -56.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.194 -0.941 . . . . 0.0 109.365 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.24 -14.86 13.0 Favored Glycine 0 C--N 1.296 -1.661 0 N-CA-C 108.741 -1.744 . . . . 0.0 108.741 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.29 -18.69 77.86 Favored Glycine 0 N--CA 1.485 1.905 0 N-CA-C 109.131 -1.588 . . . . 0.0 109.131 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 t -83.41 -50.76 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.385 -1.068 . . . . 0.0 109.063 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.6 mtm -50.41 -39.66 47.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.867 -1.145 . . . . 0.0 108.542 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.7 tt -56.98 -53.87 53.19 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.1 mttm -67.27 -52.84 35.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.12 -0.988 . . . . 0.0 110.7 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.1 tp -44.77 -40.48 6.11 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.142 -0.974 . . . . 0.0 110.163 -178.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.5 t -78.07 -45.68 27.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.927 -1.108 . . . . 0.0 109.952 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -44.67 -37.43 3.67 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.349 -0.844 . . . . 0.0 109.831 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.523 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.8 mtmp? -75.87 -39.04 57.25 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.46 -0.775 . . . . 0.0 110.775 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.442 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -62.03 -67.56 0.4 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.039 -1.038 . . . . 0.0 109.089 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.76 80.83 0.1 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.97 0.891 . . . . 0.0 110.142 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.546 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.3 p -172.52 142.06 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -68.04 31.83 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.0 110.833 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.546 ' H ' ' C ' ' A' ' 54' ' ' VAL . 1.6 tppp? -79.86 142.15 35.49 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.859 -1.151 . . . . 0.0 108.268 178.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -60.0 115.77 3.67 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.477 -0.765 . . . . 0.0 110.03 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.424 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 71.2 m95 -119.67 -43.79 2.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.569 -0.707 . . . . 0.0 109.788 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -48.67 -56.04 9.63 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.954 -1.091 . . . . 0.0 110.094 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.62 -36.84 47.46 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.133 -0.979 . . . . 0.0 108.904 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.408 ' O ' ' CZ ' ' A' ' 92' ' ' PHE . 14.7 m170 -72.49 128.02 34.34 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.888 0.851 . . . . 0.0 110.586 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.68 160.11 27.89 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.456 ' HA ' ' O ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER -99.7 148.63 24.16 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-O 122.274 1.035 . . . . 0.0 110.031 -178.65 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.47 ' CD1' ' C ' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.07 151.28 48.83 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.191 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -100.73 90.5 4.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.8 -1.188 . . . . 0.0 108.674 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.405 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 9.2 pt-20 -54.59 -23.17 15.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.17 -0.956 . . . . 0.0 110.91 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.487 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 15.7 mmtp -67.48 -10.7 53.97 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -133.93 -11.48 2.62 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.1 mpp_? 52.92 45.92 27.81 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 5.0 t -111.81 -169.91 1.55 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.282 0.563 . . . . 0.0 109.933 -178.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.489 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -128.24 103.9 7.44 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 177.707 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 10.1 mt -63.23 82.57 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.468 0 O-C-N 120.479 -1.388 . . . . 0.0 110.318 -176.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.2 pp -113.59 15.19 18.98 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.592 ' CB ' ' HZ2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -84.22 61.11 6.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.647 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -5.86 46.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.066 -1.021 . . . . 0.0 109.419 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.562 ' HD1' ' H ' ' A' ' 76' ' ' HIS . 6.4 m80 -68.79 -53.04 23.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.338 -0.852 . . . . 0.0 110.782 -179.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -97.24 -128.31 0.16 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -153.33 150.79 29.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.411 -1.431 . . . . 0.0 108.867 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 82' ' ' TYR . 1.5 pt? -40.1 -49.32 2.58 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.504 -0.748 . . . . 0.0 111.224 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.438 ' H ' HD21 ' A' ' 79' ' ' LEU . 23.0 t70 -46.91 -34.78 5.76 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.187 -0.945 . . . . 0.0 109.413 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.592 ' HZ2' ' CB ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.77 -30.44 70.65 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.534 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -79.31 -51.66 9.14 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.048 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.6 9.9 5.66 Favored Glycine 0 N--CA 1.51 3.598 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 53.2 mt -60.87 161.86 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 O-C-N 122.2 -0.588 . . . . 0.0 109.446 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -162.53 -159.02 0.54 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.255 -0.903 . . . . 0.0 109.279 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.68 -26.05 60.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.329 -0.857 . . . . 0.0 109.732 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -79.83 -1.81 40.64 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.111 -179.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.5 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.35 113.48 25.82 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.523 -0.736 . . . . 0.0 109.059 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -98.05 115.43 28.21 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.897 -1.127 . . . . 0.0 110.255 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mt -91.54 176.29 6.6 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 178.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.456 ' O ' ' HA ' ' A' ' 63' ' ' LEU . 2.6 mt-30 -142.27 148.24 37.75 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.408 ' CZ ' ' O ' ' A' ' 61' ' ' HIS . 10.0 t80 -111.34 90.88 3.46 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.235 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.531 -178.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.27 136.71 58.12 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.887 -1.133 . . . . 0.0 110.527 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . 0.432 ' SG ' ' CB ' ' B' ' 552' ' ' CYS . 0.1 OUTLIER -83.72 102.86 12.57 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 105.571 -2.011 . . . . 0.0 105.571 178.358 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.21 127.5 14.86 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.175 0.988 . . . . 0.0 110.654 -177.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.57 -26.2 25.47 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 106.788 -2.525 . . . . 0.0 106.788 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . 0.432 ' CB ' ' SG ' ' B' ' 549' ' ' CYS . 6.4 t -110.51 -30.93 7.43 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' B' ' 549' ' ' CYS . 18.2 mm-40 47.46 57.04 6.24 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-O 122.711 1.243 . . . . 0.0 112.02 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 37.3 mmtm -142.44 125.58 9.38 Favored Pre-proline 0 C--N 1.287 -2.135 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -44.03 136.41 7.62 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.415 1.184 . . . . 0.0 114.582 -178.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.8 mt -94.9 98.41 7.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.425 ' O ' ' OG1' ' B' ' 557' ' ' THR . 3.6 p -99.48 91.01 4.71 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.998 0.904 . . . . 0.0 111.179 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.06 -96.82 0.16 Allowed Glycine 0 N--CA 1.488 2.126 0 N-CA-C 107.675 -2.17 . . . . 0.0 107.675 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.12 153.31 28.42 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 20.7 p -144.09 126.5 15.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.014 -1.054 . . . . 0.0 111.558 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 51.6 mt -90.03 145.52 7.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.472 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 9.8 m -121.95 146.38 47.2 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-O 121.965 0.888 . . . . 0.0 109.193 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.764 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.34 -128.85 0.26 Allowed 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.8 mtt -65.44 25.63 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.593 -0.692 . . . . 0.0 109.255 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.764 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.07 -8.66 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 -178.082 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.57 148.94 28.87 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -95.13 174.19 7.19 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -159.95 132.05 6.3 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 118.56 -1.256 . . . . 0.0 109.81 -179.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.57 ' C ' ' H ' ' B' ' 571' ' ' GLU . 1.4 m80 -54.56 117.83 14.74 Favored Pre-proline 0 C--N 1.299 -1.593 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 176.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.585 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.1 Cg_exo -48.6 -9.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.303 -1.828 0 CA-C-N 120.48 1.207 . . . . 0.0 110.272 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.57 ' H ' ' C ' ' B' ' 569' ' ' HIS . 7.0 mt-10 -97.58 -52.85 3.63 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.62 0.724 . . . . 0.0 110.56 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -59.96 -2.72 0.44 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.612 -1.305 . . . . 0.0 109.685 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.501 ' H ' ' C ' ' B' ' 571' ' ' GLU . 5.8 t80 -128.06 56.6 1.59 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 178.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 17.0 m -95.1 177.82 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 CA-C-O 121.718 0.77 . . . . 0.0 111.5 -178.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.449 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.87 145.86 30.15 Favored 'General case' 0 N--CA 1.505 2.303 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.72 76.33 3.22 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 116.915 -1.914 . . . . 0.0 109.949 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -152.57 -60.53 0.15 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 101.252 -3.61 . . . . 0.0 101.252 173.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 21.5 p -121.04 81.51 1.79 Allowed 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 111.659 -2.518 . . . . 0.0 104.803 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.9 mp -53.62 16.88 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -176.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.0 -36.9 19.49 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.585 -1.947 . . . . 0.0 112.522 -178.613 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.585 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.27 140.09 12.57 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 119.465 -2.022 . . . . 0.0 115.073 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.449 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.3 tp -139.99 170.48 15.78 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 175.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.5 m-20 -149.38 134.55 18.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.101 -1.0 . . . . 0.0 109.098 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.472 ' CE ' ' O ' ' B' ' 562' ' ' THR . 12.3 ptpt -51.91 -19.37 1.73 Allowed 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.456 -0.778 . . . . 0.0 109.634 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -18.26 55.73 Favored Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -134.05 25.41 3.91 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.557 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.3 109.01 20.12 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 122.5 1.143 . . . . 0.0 110.232 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -104.58 169.0 8.72 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.3 tt0 -152.38 157.23 40.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.678 -1.264 . . . . 0.0 110.781 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.502 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 2.8 tp60 -155.0 146.44 23.06 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 178.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.535 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.56 23.65 0.15 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.997 -1.064 . . . . 0.0 109.909 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 82.49 -5.95 1.35 Allowed 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.816 -0.553 . . . . 0.0 110.768 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -90.27 118.91 69.18 Favored Pre-proline 0 C--N 1.295 -1.78 0 O-C-N 121.158 -0.964 . . . . 0.0 109.652 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.522 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 38.2 Cg_exo -49.27 164.98 0.25 Allowed 'Trans proline' 0 N--CA 1.491 1.335 0 CA-C-N 119.996 1.034 . . . . 0.0 112.288 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.522 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 22.5 m-85 -170.8 139.58 1.52 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.224 -0.923 . . . . 0.0 109.866 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.1 m -70.02 154.63 41.7 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.424 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.08 -55.53 33.79 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 179.183 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.98 -29.32 4.68 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.41 -58.47 3.11 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.613 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -60.27 -59.48 5.35 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.81 -0.556 . . . . 0.0 110.246 -179.764 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.613 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -46.55 -38.7 9.79 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.366 -0.834 . . . . 0.0 109.36 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -63.19 -20.71 65.66 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.542 -0.724 . . . . 0.0 110.855 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 3.0 mt -92.11 -57.3 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.75 -1.219 . . . . 0.0 111.239 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.498 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 10.5 m-85 -96.07 12.03 32.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.16 -0.963 . . . . 0.0 109.905 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 26.4 m . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.25 179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.351 0 N-CA-C 108.198 -1.961 . . . . 0.0 108.198 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.502 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 21.8 p -89.98 124.14 34.49 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.809 -0.818 . . . . 0.0 110.619 -178.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -119.0 122.15 41.52 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 177.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -79.37 128.78 33.76 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.106 -0.996 . . . . 0.0 109.975 -178.837 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.468 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -84.47 133.96 34.46 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.776 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.81 34.59 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -178.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.4 t -135.31 107.31 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 CA-C-O 121.802 0.81 . . . . 0.0 109.117 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -78.62 103.71 8.75 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -71.24 98.92 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.517 ' C ' ' H ' ' A' ' 27' ' ' LEU . 19.7 p -68.19 -48.56 64.91 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.826 -0.546 . . . . 0.0 111.161 -177.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.91 12.22 0.23 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.753 -1.217 . . . . 0.0 109.698 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.517 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -141.36 -24.98 0.72 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 77.15 13.25 2.08 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 122.041 -0.412 . . . . 0.0 110.234 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.5 mtp-105 -96.92 -178.16 4.13 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 120.966 -1.084 . . . . 0.0 109.687 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -137.51 114.23 10.47 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.419 HG12 ' HZ3' ' A' ' 51' ' ' LYS . 30.3 t -110.65 157.65 11.35 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.72 135.3 46.73 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.488 ' CD2' ' N ' ' A' ' 33' ' ' LEU . 3.8 mm? -109.15 110.44 21.67 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.685 -0.634 . . . . 0.0 109.416 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.502 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.9 tpt180 -60.87 101.73 0.16 Allowed 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.7 m -133.55 -169.63 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-O 122.187 0.994 . . . . 0.0 110.742 -178.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.7 p -142.4 174.51 10.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.26 45.51 3.04 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -146.61 4.87 0.9 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.595 -0.944 . . . . 0.0 108.948 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.5 m -89.83 138.28 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.122 -0.986 . . . . 0.0 110.335 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.5 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.1 m-70 -82.0 146.12 29.88 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.025 -1.047 . . . . 0.0 108.585 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 73.7 mt -47.36 -56.5 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.953 -1.092 . . . . 0.0 109.896 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.02 -14.89 4.57 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.378 -1.889 . . . . 0.0 108.378 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.5 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.08 -27.49 58.06 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 108.511 -1.835 . . . . 0.0 108.511 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.405 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.18 -39.32 19.15 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 38.6 mtm -51.39 -40.05 58.44 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -62.95 -58.41 7.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.623 -0.673 . . . . 0.0 109.931 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -54.95 -59.75 4.31 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.425 -0.797 . . . . 0.0 111.234 -178.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.7 tp -45.51 -38.26 6.13 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.958 -1.089 . . . . 0.0 109.716 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.24 -53.93 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -45.34 -47.25 13.32 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.188 0.518 . . . . 0.0 110.975 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.419 ' HZ3' HG12 ' A' ' 31' ' ' VAL . 7.3 mtmp? -60.85 -58.06 10.06 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.229 -0.919 . . . . 0.0 110.634 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.6 tp -55.52 -49.99 71.15 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 t70 66.05 74.96 0.35 Allowed 'General case' 0 C--N 1.299 -1.617 0 CA-C-O 121.805 0.812 . . . . 0.0 109.989 178.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.479 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.31 144.68 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.999 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.979 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' CB ' ' B' ' 576' ' ' ALA . 20.6 mmtt -71.84 45.29 0.11 Allowed 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.535 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 40.8 tttm -76.26 171.18 14.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.415 -0.803 . . . . 0.0 110.429 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 8.4 m-20 -50.89 91.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.366 -0.833 . . . . 0.0 110.357 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 67.7 m95 -113.55 -13.51 12.76 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 122.282 1.039 . . . . 0.0 109.102 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.6 t -57.39 -54.11 50.47 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-O 121.778 0.799 . . . . 0.0 109.787 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.432 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 54.5 t0 -91.26 12.56 19.86 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.76 -0.588 . . . . 0.0 110.684 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.46 134.77 48.09 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.124 -0.985 . . . . 0.0 110.023 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.74 148.52 4.36 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.572 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.3 mm? -95.6 148.35 22.61 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.859 -1.151 . . . . 0.0 110.611 -178.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.522 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -129.94 137.65 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -99.7 91.67 4.97 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.483 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 16.5 pt-20 -57.51 -22.01 41.53 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.965 -1.084 . . . . 0.0 110.553 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.494 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -62.95 -13.38 34.05 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 177.762 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.444 ' N ' ' C ' ' A' ' 66' ' ' GLU . 18.9 mmtt -130.85 -12.8 3.71 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.477 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.4 mpp_? 54.11 45.9 26.52 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 -177.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.61 -175.42 2.67 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.647 0.737 . . . . 0.0 109.957 -178.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.467 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.67 102.35 7.3 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 177.655 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -62.01 87.01 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.262 0 O-C-N 120.431 -1.418 . . . . 0.0 110.433 -176.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.7 pp -124.52 10.91 8.54 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 82.61 7.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.209 -0.932 . . . . 0.0 108.895 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.47 -12.06 60.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.095 -1.003 . . . . 0.0 109.984 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.669 ' H ' ' CD2' ' A' ' 76' ' ' HIS . 0.6 OUTLIER -90.78 44.07 1.18 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.866 -1.147 . . . . 0.0 109.468 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.521 ' CG ' ' O ' ' A' ' 76' ' ' HIS . 1.3 m0 -173.42 -169.87 0.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.647 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -139.97 -169.19 2.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.898 -1.126 . . . . 0.0 109.692 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.511 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.8 mp -65.25 -60.0 3.47 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -45.68 -52.83 10.24 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.857 0.837 . . . . 0.0 109.804 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.647 ' CG ' ' H ' ' A' ' 78' ' ' THR . 36.7 mmtt -45.43 -55.96 5.53 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.639 0.733 . . . . 0.0 109.731 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -41.73 69.63 Favored 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 119.827 -0.749 . . . . 0.0 109.155 -179.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.3 11.53 6.73 Favored Glycine 0 N--CA 1.5 2.908 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 43.1 mt -71.23 160.71 5.08 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.606 -0.937 . . . . 0.0 109.513 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.76 -165.15 0.42 Allowed 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.94 -22.23 62.25 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.417 -0.802 . . . . 0.0 110.098 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -79.93 -10.0 59.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.157 -0.964 . . . . 0.0 108.844 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.468 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.93 112.83 25.09 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.9 115.59 27.97 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 109.964 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.4 mt -90.12 176.22 6.85 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.466 ' NE2' ' CZ2' ' A' ' 64' ' ' TRP . 1.2 mt-30 -140.63 148.93 41.64 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.1 OUTLIER -96.0 142.52 28.11 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.1 t . . . . . 0 N--CA 1.496 1.846 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 179.449 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.3 mp -59.38 135.56 57.69 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.888 -1.133 . . . . 0.0 110.653 -178.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.89 103.97 13.59 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 18.3 t -51.65 127.21 19.83 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.201 1.001 . . . . 0.0 109.659 -177.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.74 -34.21 5.6 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.142 -2.783 . . . . 0.0 106.142 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.1 m -106.23 -36.2 6.95 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.429 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.0 mm-40 55.72 56.37 6.21 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 122.639 1.209 . . . . 0.0 109.942 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.7 mmtm -140.53 124.06 10.32 Favored Pre-proline 0 N--CA 1.496 1.851 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -44.2 135.17 8.58 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 120.492 1.211 . . . . 0.0 114.855 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.54 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.8 mt -94.04 99.3 9.31 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 80.9 p -100.82 91.7 4.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.307 -0.871 . . . . 0.0 111.238 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.96 -96.59 0.16 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 107.334 -2.306 . . . . 0.0 107.334 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.489 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.3 mmt-85 -112.12 152.9 27.75 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.4 p -145.18 126.13 14.5 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.978 -1.076 . . . . 0.0 111.577 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.8 mt -90.54 146.07 6.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 178.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.468 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 8.9 m -120.0 146.54 45.76 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 121.916 0.865 . . . . 0.0 109.283 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.757 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.19 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.803 0 CA-C-O 121.605 0.717 . . . . 0.0 109.406 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.548 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.1 mtt -65.66 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.688 0 O-C-N 121.617 -0.677 . . . . 0.0 109.272 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.757 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.46 -9.05 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.17 159.99 24.49 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -103.84 174.68 5.77 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -160.09 133.58 6.98 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.268 -1.373 . . . . 0.0 110.005 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.568 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -54.16 114.3 6.35 Favored Pre-proline 0 C--N 1.302 -1.49 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.554 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 36.8 Cg_exo -46.96 -9.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.422 0 CA-C-N 120.331 1.154 . . . . 0.0 111.535 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.568 ' N ' ' O ' ' B' ' 569' ' ' HIS . 11.9 mt-10 -98.69 -52.92 3.45 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.011 0.91 . . . . 0.0 110.008 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.559 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -56.91 -4.86 0.19 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.917 -1.114 . . . . 0.0 109.87 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.514 ' H ' ' C ' ' B' ' 571' ' ' GLU . 30.1 t80 -125.47 53.7 1.53 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 16.9 m -93.1 178.26 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 122.17 0.986 . . . . 0.0 110.487 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.466 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.42 150.93 28.14 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.21 -179.499 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . 0.568 ' CB ' ' NZ ' ' A' ' 55' ' ' LYS . . . -96.24 76.85 3.03 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 117.219 -1.792 . . . . 0.0 110.031 178.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . 0.48 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 27.9 t80 -152.65 -44.38 0.1 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 173.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.2 p -137.3 125.62 23.28 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 111.71 -2.495 . . . . 0.0 106.624 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.78 13.72 0.78 Allowed 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.055 -1.028 . . . . 0.0 111.84 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.403 ' HD3' ' H ' ' B' ' 581' ' ' GLN . 0.0 OUTLIER -91.93 -39.7 11.56 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-N 121.614 2.007 . . . . 0.0 115.204 -175.272 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.554 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.97 141.91 8.6 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 122.377 2.353 . . . . 0.0 116.09 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.466 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.9 tp -140.38 168.66 19.29 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 174.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 68.7 m-20 -147.67 134.98 20.62 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.066 -1.021 . . . . 0.0 109.163 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.468 ' CE ' ' O ' ' B' ' 562' ' ' THR . 11.3 ptpt -55.4 -14.13 1.77 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.73 0.776 . . . . 0.0 109.53 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -95.62 -14.97 45.04 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.6 p -136.41 26.79 3.14 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.94 -0.741 . . . . 0.0 109.083 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.56 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 2.8 p90 -88.25 109.39 19.9 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 122.32 1.057 . . . . 0.0 109.176 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.88 159.35 15.14 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.442 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.5 tt0 -155.24 157.25 37.0 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 122.699 1.237 . . . . 0.0 111.456 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.442 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 3.7 pt20 -160.9 146.19 14.33 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.702 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.32 22.97 1.54 Allowed 'General case' 0 C--N 1.287 -2.129 0 O-C-N 121.263 -0.898 . . . . 0.0 109.155 -178.572 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.57 -7.07 1.47 Allowed 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.775 -0.578 . . . . 0.0 111.819 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -87.83 116.12 65.18 Favored Pre-proline 0 C--N 1.294 -1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 110.643 -178.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 34.6 Cg_exo -53.05 164.31 1.75 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 CA-C-N 119.883 0.994 . . . . 0.0 112.147 178.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.0 m-85 -171.04 139.91 1.46 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.287 -0.883 . . . . 0.0 110.229 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.53 155.14 40.96 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 103.529 -2.767 . . . . 0.0 103.529 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.462 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.15 -55.91 28.95 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.062 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.35 -26.97 0.92 Allowed 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.682 -0.636 . . . . 0.0 109.455 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 23.2 m -84.8 -60.23 2.12 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.479 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.6 OUTLIER -55.76 -54.66 41.68 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.684 . . . . 0.0 109.273 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.479 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -48.71 -41.79 32.99 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.628 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.78 -26.95 15.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 109.016 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.3 mt -92.68 -57.25 2.73 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.195 -0.941 . . . . 0.0 111.25 -177.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' O ' ' B' ' 605' ' ' CYS . 11.6 m-85 -102.08 32.13 3.62 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.318 -0.864 . . . . 0.0 110.022 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.409 ' O ' ' O ' ' B' ' 604' ' ' PHE . 9.5 t . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 117.923 -1.037 . . . . 0.0 109.713 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.492 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.491 2.347 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 p -85.67 122.86 30.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.611 -0.934 . . . . 0.0 110.427 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.492 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -137.81 122.52 18.69 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.788 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.538 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.74 130.11 36.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.225 -0.922 . . . . 0.0 108.717 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.491 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.6 133.7 34.83 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.2 145.5 35.53 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.242 -0.911 . . . . 0.0 109.62 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.5 t -138.16 106.25 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-O 121.9 0.857 . . . . 0.0 109.683 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -80.62 103.71 10.66 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.58 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.2 t -72.41 103.48 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.53 ' C ' ' H ' ' A' ' 27' ' ' LEU . 4.1 p -69.03 -65.55 0.69 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 110.89 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' N ' ' OG1' ' A' ' 25' ' ' THR . 25.7 t70 -49.35 -9.25 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.047 -1.033 . . . . 0.0 110.393 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.53 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.2 mt -120.86 -23.76 5.83 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.383 -0.823 . . . . 0.0 108.941 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.58 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 74.27 13.92 3.82 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 122.143 -0.348 . . . . 0.0 110.406 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.425 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 56.6 mtp85 -97.25 -178.53 4.2 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.925 -1.11 . . . . 0.0 109.791 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 29' ' ' ARG . 83.7 m-20 -138.39 118.24 13.26 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.6 t -120.47 157.9 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.557 0.694 . . . . 0.0 109.629 -179.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.11 136.63 45.94 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -114.46 113.04 23.94 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -60.28 101.97 0.15 Allowed 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 179.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.9 m -132.59 -174.9 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 CA-C-O 121.925 0.869 . . . . 0.0 110.316 -178.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 38' ' ' GLU . 10.7 p -141.11 175.56 9.53 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.59 49.02 3.3 Favored Glycine 0 C--N 1.292 -1.882 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.41 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.7 OUTLIER -145.72 -4.65 0.66 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.44 -1.036 . . . . 0.0 109.021 -179.952 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.404 HG11 ' H ' ' A' ' 36' ' ' THR . 1.2 m -87.5 150.29 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.162 -0.961 . . . . 0.0 110.455 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.467 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -90.3 138.72 31.31 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.608 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.474 ' C ' ' H ' ' A' ' 43' ' ' GLY . 38.7 mt -50.58 -49.03 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.953 -1.092 . . . . 0.0 108.499 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.49 -13.76 3.04 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 108.287 -1.925 . . . . 0.0 108.287 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.474 ' H ' ' C ' ' A' ' 41' ' ' ILE . . . -79.67 -38.56 20.08 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 108.155 -1.978 . . . . 0.0 108.155 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.61 -43.21 94.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.4 mtm -50.95 -32.78 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -77.94 -64.06 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.228 0.537 . . . . 0.0 109.939 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -51.63 -59.38 4.34 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.193 -0.942 . . . . 0.0 110.863 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.82 -55.25 5.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.151 -0.968 . . . . 0.0 108.78 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.2 t -56.81 -52.42 54.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 O-C-N 121.839 -0.538 . . . . 0.0 109.589 179.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -44.55 -40.51 5.75 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.204 -0.935 . . . . 0.0 110.159 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.471 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -71.66 -27.9 63.38 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.2 tp -65.75 -58.63 5.21 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.186 -0.946 . . . . 0.0 109.031 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t0 69.17 72.06 0.26 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.765 0.793 . . . . 0.0 110.698 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.572 ' C ' ' H ' ' A' ' 56' ' ' LYS . 3.1 p -175.25 138.62 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.96 34.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.13 -0.981 . . . . 0.0 109.641 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.572 ' H ' ' C ' ' A' ' 54' ' ' VAL . 6.6 ttpm? -78.03 168.81 19.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.041 -1.037 . . . . 0.0 109.469 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.457 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -50.17 109.36 0.29 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.455 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 44.3 m0 -103.83 -89.47 0.4 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 61' ' ' HIS . 4.9 t -43.6 -48.21 7.59 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.17 -0.956 . . . . 0.0 110.492 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' SER . 9.0 t0 -43.7 -19.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 1.6 p-80 -88.52 167.52 13.36 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 122.021 0.915 . . . . 0.0 109.821 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.54 153.12 4.97 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -94.07 147.16 23.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.973 -1.08 . . . . 0.0 109.288 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TRP . . . . . 0.525 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -133.27 137.02 45.86 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.719 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -96.46 91.28 5.73 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.461 ' C ' ' N ' ' A' ' 68' ' ' LYS . 13.3 pt-20 -57.16 -21.99 36.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.806 -1.184 . . . . 0.0 110.197 -178.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -62.16 -15.3 45.14 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 177.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.461 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -130.3 -12.56 4.01 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.755 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.516 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.2 mpp_? 54.42 45.96 26.0 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 -177.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.7 t -114.36 -173.29 2.26 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.443 0.639 . . . . 0.0 110.237 -178.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.425 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -123.95 102.95 8.04 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 177.557 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.1 mt -63.15 88.75 0.03 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.367 -1.458 . . . . 0.0 110.617 -176.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.455 ' H ' ' HE3' ' A' ' 74' ' ' LYS . 3.1 pp -120.78 10.1 10.86 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.54 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -72.22 38.62 0.07 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.134 -0.979 . . . . 0.0 110.846 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -6.84 0.22 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.287 -1.508 . . . . 0.0 108.704 179.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . 0.54 ' H ' ' C ' ' A' ' 74' ' ' LYS . 16.1 t60 -59.86 -77.05 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 110.035 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -82.34 -118.7 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.098 -1.001 . . . . 0.0 109.647 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.466 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -153.75 150.56 28.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.642 -1.286 . . . . 0.0 109.757 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.531 ' O ' ' N ' ' A' ' 82' ' ' TYR . 1.5 pt? -43.86 -47.6 8.25 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.064 -1.022 . . . . 0.0 110.021 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.453 ' H ' HD21 ' A' ' 79' ' ' LEU . 7.2 t70 -47.38 -34.17 6.72 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.312 -0.867 . . . . 0.0 109.518 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.5 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.1 -30.34 70.33 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -179.44 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 79' ' ' LEU . 1.1 t80 -81.37 -49.62 10.46 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 122.82 9.4 6.29 Favored Glycine 0 N--CA 1.512 3.754 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.541 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 47.0 mt -60.87 161.73 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 O-C-N 122.075 -0.662 . . . . 0.0 109.242 179.464 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.39 -168.28 1.49 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.91 . . . . 0.0 109.438 179.356 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.64 -26.55 67.12 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.294 -0.879 . . . . 0.0 109.896 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -76.79 -10.09 59.13 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.13 112.32 24.13 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.4 mmtp -97.54 117.29 31.49 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.944 -1.098 . . . . 0.0 109.837 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.2 mt -95.64 175.62 6.47 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.41 ' NE2' ' CH2' ' A' ' 64' ' ' TRP . 8.1 mt-30 -134.08 161.56 34.51 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 3.4 t80 -122.94 125.62 45.66 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.498 1.964 0 O-C-N 121.36 -0.837 . . . . 0.0 108.866 -179.219 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 547' ' ' SER . . . . . 0.556 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.4 mp -58.93 135.84 57.7 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.77 -1.206 . . . . 0.0 110.828 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -84.14 104.13 13.93 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 178.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.2 t -51.77 127.06 19.68 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 122.137 0.97 . . . . 0.0 109.599 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.84 -33.24 6.15 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 106.199 -2.76 . . . . 0.0 106.199 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.4 m -107.65 -35.94 6.57 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 553' ' ' GLN . . . . . 0.427 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.6 mm-40 55.58 56.38 6.29 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 122.61 1.195 . . . . 0.0 110.038 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -140.62 124.08 10.24 Favored Pre-proline 0 C--N 1.293 -1.863 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -44.05 136.02 7.84 Favored 'Trans proline' 0 N--CA 1.494 1.526 0 CA-C-N 120.441 1.193 . . . . 0.0 115.113 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 556' ' ' ILE . . . . . 0.556 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.7 mt -95.35 97.97 7.37 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 557' ' ' THR . . . . . 0.423 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.2 p -100.07 91.37 4.75 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.227 -0.92 . . . . 0.0 111.279 -177.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.3 -95.18 0.15 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 107.532 -2.227 . . . . 0.0 107.532 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 559' ' ' ARG . . . . . 0.482 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.0 mmt-85 -114.04 152.71 30.59 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 18.6 p -144.63 126.25 15.09 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.947 -1.096 . . . . 0.0 111.605 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -90.74 146.48 6.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 562' ' ' THR . . . . . 0.661 ' H ' ' HZ3' ' B' ' 584' ' ' LYS . 7.1 m -118.2 147.29 43.53 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 121.834 0.826 . . . . 0.0 109.226 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 563' ' ' ALA . . . . . 0.759 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.94 -129.08 0.25 Allowed 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.563 0.697 . . . . 0.0 109.495 -178.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 564' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.7 mtp -65.66 26.3 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 565' ' ' ALA . . . . . 0.759 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.95 -9.07 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.3 163.14 23.14 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 567' ' ' LYS . . . . . 0.508 ' O ' ' CD1' ' B' ' 568' ' ' PHE . 18.6 mmmt -104.8 174.56 5.83 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 568' ' ' PHE . . . . . 0.508 ' CD1' ' O ' ' B' ' 567' ' ' LYS . 2.9 m-85 -159.81 132.01 6.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.526 -1.359 . . . . 0.0 110.219 -178.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 569' ' ' HIS . . . . . 0.576 ' ND1' ' ND1' ' B' ' 572' ' ' HIS . 9.0 m80 -53.3 113.4 4.68 Favored Pre-proline 0 C--N 1.305 -1.347 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 176.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 570' ' ' PRO . . . . . 0.602 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 31.2 Cg_exo -47.66 -13.26 0.17 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 CA-C-N 120.426 1.188 . . . . 0.0 110.802 -178.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 571' ' ' GLU . . . . . 0.537 ' N ' ' O ' ' B' ' 569' ' ' HIS . 5.9 mt-10 -92.22 -52.19 4.81 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 122.079 0.943 . . . . 0.0 110.359 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 572' ' ' HIS . . . . . 0.576 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -59.93 -5.67 1.06 Allowed 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.086 -1.009 . . . . 0.0 110.046 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 573' ' ' PHE . . . . . 0.43 ' H ' ' C ' ' B' ' 571' ' ' GLU . 36.4 t80 -127.72 56.01 1.6 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 16.2 m -94.85 177.27 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.765 0.793 . . . . 0.0 111.448 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 575' ' ' CYS . . . . . 0.448 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.63 143.02 32.22 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 178.599 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.12 73.12 6.33 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 116.065 -2.254 . . . . 0.0 108.703 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 577' ' ' PHE . . . . . 0.416 ' O ' ' N ' ' A' ' 59' ' ' SER . 0.4 OUTLIER -157.52 -36.95 0.07 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 173.883 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 578' ' ' CYS . . . . . 0.584 ' O ' ' N ' ' B' ' 580' ' ' LYS . 29.8 p -137.12 82.43 1.93 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 178.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 579' ' ' LEU . . . . . 0.622 ' CD1' ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.46 13.96 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -176.493 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 580' ' ' LYS . . . . . 0.584 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -96.05 -38.3 10.26 Favored 'General case' 0 N--CA 1.505 2.323 0 CA-C-N 121.369 1.895 . . . . 0.0 113.024 -178.73 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 581' ' ' GLN . . . . . 0.602 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.6 tp60 -160.64 140.2 10.85 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 119.47 -2.019 . . . . 0.0 115.652 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 582' ' ' LEU . . . . . 0.448 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 23.2 tp -135.07 170.1 16.42 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 583' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' B' ' 587' ' ' PHE . 79.2 m-20 -144.8 129.23 17.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.051 -1.031 . . . . 0.0 109.261 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 584' ' ' LYS . . . . . 0.661 ' HZ3' ' H ' ' B' ' 562' ' ' THR . 0.3 OUTLIER -53.85 -16.17 1.66 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.418 -0.801 . . . . 0.0 109.514 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.88 -17.76 53.07 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.8 p -135.63 28.94 3.26 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 587' ' ' PHE . . . . . 0.573 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 1.1 p90 -88.93 106.1 18.19 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 122.762 1.268 . . . . 0.0 109.738 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 588' ' ' LYS . . . . . 0.53 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.05 167.66 10.75 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 589' ' ' GLU . . . . . 0.445 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.7 tt0 -152.07 156.96 40.95 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 122.679 1.228 . . . . 0.0 110.593 -179.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 590' ' ' GLN . . . . . 0.562 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -158.59 146.47 18.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 591' ' ' ASN . . . . . 0.562 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 47.1 22.37 0.22 Allowed 'General case' 0 C--N 1.296 -1.746 0 O-C-N 121.008 -1.057 . . . . 0.0 109.906 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 81.07 -3.96 1.72 Allowed 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.664 -0.648 . . . . 0.0 111.149 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -89.6 123.57 66.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 O-C-N 121.116 -0.99 . . . . 0.0 109.125 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 594' ' ' PRO . . . . . 0.494 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 45.8 Cg_exo -48.26 165.44 0.15 Allowed 'Trans proline' 0 N--CA 1.485 1.026 0 CA-C-N 120.301 1.143 . . . . 0.0 110.923 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 595' ' ' TYR . . . . . 0.53 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.1 m-85 -170.3 141.1 1.97 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.734 -1.229 . . . . 0.0 111.204 -178.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 26.4 m -78.63 154.2 30.44 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 104.627 -2.36 . . . . 0.0 104.627 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 597' ' ' GLN . . . . . 0.478 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.44 -56.5 19.47 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -44.97 -33.85 2.19 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.63 0.729 . . . . 0.0 109.741 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 68.0 m -78.66 -62.85 1.56 Allowed 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.419 -0.801 . . . . 0.0 110.015 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 600' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -57.78 -47.57 82.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 122.102 -0.374 . . . . 0.0 111.937 -178.17 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 601' ' ' LEU . . . . . 0.523 ' CD2' ' N ' ' B' ' 602' ' ' LYS . 0.0 OUTLIER -56.28 -51.4 68.31 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 120.721 -1.237 . . . . 0.0 108.438 -177.892 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 602' ' ' LYS . . . . . 0.523 ' N ' ' CD2' ' B' ' 601' ' ' LEU . 18.5 tttt -45.56 -24.93 0.38 Allowed 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.389 -0.82 . . . . 0.0 109.972 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.91 -57.03 2.47 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.078 -1.014 . . . . 0.0 111.161 -178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 604' ' ' PHE . . . . . 0.501 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 37.8 m-85 -97.92 22.42 9.29 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.153 -0.967 . . . . 0.0 110.336 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 605' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 58.2 m . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.343 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.4 mmt . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 122.164 0.983 . . . . 0.0 109.692 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.89 -49.81 0.07 Allowed 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.273 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.609 ' C ' ' H ' ' A' ' 5' ' ' GLY . 54.6 mt -42.77 -77.68 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 122.025 0.917 . . . . 0.0 109.751 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 7.4 t0 61.29 -7.04 0.1 Allowed 'General case' 0 C--N 1.296 -1.718 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.801 -179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.609 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 116.73 -12.89 15.16 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.348 -1.901 . . . . 0.0 108.348 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.513 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -114.45 -103.83 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -179.157 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.595 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -156.49 -99.26 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.275 0 O-C-N 120.546 -1.346 . . . . 0.0 109.949 -179.404 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.595 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -144.66 -62.46 0.02 OUTLIER Pre-proline 0 N--CA 1.502 2.135 0 O-C-N 120.981 -1.074 . . . . 0.0 110.717 -179.248 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -43.1 -32.4 2.9 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 CA-C-N 121.238 1.478 . . . . 0.0 109.89 178.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -117.68 -25.02 7.01 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 114.637 -1.165 . . . . 0.0 107.95 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.09 13.82 65.2 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 8' ' ' MET . 12.6 t -164.36 -67.85 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.55 -0.971 . . . . 0.0 109.735 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.524 ' O ' ' CB ' ' A' ' 14' ' ' ALA . 3.5 t80 80.66 -46.84 0.27 Allowed 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 -178.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.524 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 157.47 -35.96 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -166.95 3.45 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.228 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.68 30.07 41.05 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.676 ' HG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -96.16 125.66 40.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.273 -1.134 . . . . 0.0 109.999 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.468 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -128.97 120.97 27.03 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 178.18 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.86 127.74 33.91 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.963 -1.086 . . . . 0.0 109.02 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.477 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.95 134.59 34.65 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -77.98 145.4 36.04 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.487 -0.885 . . . . 0.0 108.981 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.84 104.06 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-O 121.829 0.823 . . . . 0.0 109.909 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -79.66 104.5 10.3 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.507 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.6 t -74.76 118.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.047 -1.461 . . . . 0.0 109.114 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.3 p -85.32 -25.96 26.85 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.411 -0.806 . . . . 0.0 109.39 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -78.04 -8.16 57.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 108.702 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mt -130.3 -22.64 2.77 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 75.47 12.56 3.16 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.331 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.427 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 74.9 mtp180 -95.32 -178.62 4.5 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.161 -0.962 . . . . 0.0 109.661 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 29' ' ' ARG . 72.4 m-20 -136.16 113.93 11.12 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 t -113.87 157.54 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-O 121.342 0.592 . . . . 0.0 109.489 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.51 135.99 50.18 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -115.34 113.55 23.95 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.777 -0.577 . . . . 0.0 109.743 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.676 ' NE ' ' HG1' ' A' ' 17' ' ' THR . 9.0 tpt180 -60.25 105.6 0.43 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.9 m -134.18 -169.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.908 0.861 . . . . 0.0 110.591 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p -140.44 172.42 12.75 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.468 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -79.94 46.48 3.15 Favored Glycine 0 N--CA 1.485 1.903 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -149.75 4.31 0.57 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.675 -0.897 . . . . 0.0 108.928 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 m -87.02 137.29 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.945 -1.097 . . . . 0.0 109.959 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.488 ' O ' ' N ' ' A' ' 43' ' ' GLY . 4.2 m80 -79.73 147.83 31.76 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.042 -1.037 . . . . 0.0 108.656 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.463 ' C ' ' H ' ' A' ' 43' ' ' GLY . 59.5 mt -48.46 -52.56 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.126 -0.984 . . . . 0.0 109.381 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.64 -15.24 4.28 Favored Glycine 0 N--CA 1.484 1.857 0 N-CA-C 108.107 -1.997 . . . . 0.0 108.107 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -81.43 -28.32 44.4 Favored Glycine 0 N--CA 1.481 1.698 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.401 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.16 -55.29 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -1.126 . . . . 0.0 109.487 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -37.2 30.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.715 -1.24 . . . . 0.0 108.859 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.5 tp -57.52 -65.57 0.61 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.204 -0.935 . . . . 0.0 109.412 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -51.42 -59.46 4.21 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.409 -0.807 . . . . 0.0 111.523 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.1 tp -45.78 -46.07 15.08 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.091 -1.006 . . . . 0.0 109.83 -178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.49 ' O ' ' N ' ' A' ' 52' ' ' LEU . 11.6 t -67.21 -48.38 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.032 -1.043 . . . . 0.0 108.826 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -45.04 -40.42 6.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.354 -0.841 . . . . 0.0 109.683 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -66.74 -31.9 72.86 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.349 -0.844 . . . . 0.0 108.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 49' ' ' VAL . 3.7 tp -67.7 -66.55 0.55 Allowed 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 t70 64.42 75.89 0.36 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.747 0.784 . . . . 0.0 110.051 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.577 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.5 p -173.07 152.55 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 C-N-CA 120.186 -0.605 . . . . 0.0 109.799 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -71.01 37.52 0.05 Allowed 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.577 ' H ' ' C ' ' A' ' 54' ' ' VAL . 19.2 tttp -77.97 179.97 6.44 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.082 -1.011 . . . . 0.0 109.237 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.521 ' N ' ' OD2' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -60.13 92.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.312 -0.867 . . . . 0.0 110.223 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 16.4 m0 -91.07 -35.98 14.29 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.253 -0.904 . . . . 0.0 109.511 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.593 ' C ' ' H ' ' A' ' 61' ' ' HIS . 3.7 t -73.99 -34.37 64.18 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.967 -1.083 . . . . 0.0 108.838 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -71.88 19.27 0.07 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.639 ' CD2' ' CE1' ' A' ' 92' ' ' PHE . 5.7 t-80 -105.65 130.43 53.68 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 122.024 0.916 . . . . 0.0 111.864 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.563 ' N ' ' HD1' ' A' ' 61' ' ' HIS . . . -170.02 145.19 2.84 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.546 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.1 mm? -94.93 143.03 26.8 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.771 -1.206 . . . . 0.0 110.363 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.522 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.73 150.03 49.97 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.31 93.61 4.6 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.029 -1.044 . . . . 0.0 108.725 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -55.21 -23.73 23.73 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 111.058 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.507 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.2 mmtp -69.23 -8.89 49.99 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 178.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.6 mmtt -133.32 -12.43 2.77 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.731 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.39 46.21 27.09 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -178.148 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.465 ' HG1' ' H ' ' A' ' 71' ' ' TRP . 5.6 t -112.43 -172.93 2.14 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.362 0.601 . . . . 0.0 109.868 -178.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.557 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.04 98.66 5.2 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 177.424 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.0 mt -60.34 91.01 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 122.618 1.199 . . . . 0.0 109.984 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 71' ' ' TRP . 1.9 pp -123.64 14.55 9.44 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.605 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.44 72.36 6.98 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.275 -0.891 . . . . 0.0 109.332 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 m -62.38 -13.67 31.9 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.978 -1.076 . . . . 0.0 110.002 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.69 -50.91 15.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.102 -0.999 . . . . 0.0 109.767 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -172.14 1.65 Allowed 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.661 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -137.73 -164.92 1.69 Allowed 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.626 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.533 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.0 mp -69.72 -59.63 2.83 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -46.91 -51.99 15.53 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.137 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.661 ' CG ' ' H ' ' A' ' 78' ' ' THR . 33.8 mmtt -44.91 -55.01 5.84 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.542 0.687 . . . . 0.0 109.966 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.23 -40.22 59.25 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.136 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.88 7.01 8.91 Favored Glycine 0 N--CA 1.5 2.95 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.528 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 52.8 mt -62.0 160.86 2.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.45 -1.029 . . . . 0.0 109.386 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.92 -163.47 0.26 Allowed 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.1 62.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.88 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -75.12 -9.93 59.0 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.68 113.64 26.22 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -94.46 116.53 28.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.985 -1.072 . . . . 0.0 109.524 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.1 mt -94.81 176.79 6.13 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.444 0.64 . . . . 0.0 109.296 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.522 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.8 mt-30 -132.35 159.25 39.74 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.639 ' CE1' ' CD2' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -115.89 94.2 4.58 Favored 'General case' 0 N--CA 1.503 2.183 0 CA-C-O 122.484 1.135 . . . . 0.0 108.023 179.237 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.439 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -146.67 161.07 39.33 Favored Pre-proline 0 N--CA 1.492 1.675 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.493 1.482 0 C-N-CA 122.311 2.007 . . . . 0.0 111.737 179.813 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . 0.421 ' O ' ' O ' ' B' ' 542' ' ' HIS . 7.0 p90 . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . 0.516 ' ND1' ' N ' ' B' ' 542' ' ' HIS . 1.4 m-70 -57.78 -162.35 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.239 -0.913 . . . . 0.0 109.524 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -139.7 -4.53 1.4 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.329 -0.857 . . . . 0.0 109.757 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.473 ' HG2' HH21 ' B' ' 544' ' ' ARG . 0.7 OUTLIER -65.73 103.06 0.82 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.056 -1.027 . . . . 0.0 109.639 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.514 ' NH1' ' O ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -94.09 -153.31 0.37 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.26 -0.9 . . . . 0.0 108.72 179.875 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . 0.514 ' O ' ' NH1' ' B' ' 545' ' ' ARG . . . -170.15 -98.72 0.12 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.542 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -167.34 118.74 0.89 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.281 -1.129 . . . . 0.0 108.161 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.25 135.75 57.82 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 120.855 -1.153 . . . . 0.0 110.315 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.81 103.9 13.46 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.5 t -51.21 127.05 18.34 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 122.191 0.996 . . . . 0.0 109.59 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.67 -34.59 5.39 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 106.161 -2.776 . . . . 0.0 106.161 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.85 -35.57 7.29 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.5 mm-40 55.02 56.37 6.67 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.699 1.237 . . . . 0.0 109.957 -178.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -140.64 123.78 10.06 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -44.21 135.38 8.54 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 CA-C-N 120.489 1.21 . . . . 0.0 114.604 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.1 mt -93.4 98.34 8.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.424 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.3 p -99.38 91.57 5.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.246 -0.909 . . . . 0.0 111.223 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.6 -95.26 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.481 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -114.76 152.33 32.26 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 177.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.6 126.53 15.4 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.932 -1.105 . . . . 0.0 111.541 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.9 mt -91.01 146.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 7.9 m -118.48 146.94 44.11 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-O 121.79 0.805 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.738 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.53 -129.39 0.26 Allowed 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.604 0.716 . . . . 0.0 109.331 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.554 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.3 mtt -65.78 26.34 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.738 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.01 -8.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.73 161.0 23.5 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.73 174.29 5.94 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -160.2 136.34 8.64 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.233 -1.387 . . . . 0.0 109.861 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.572 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.61 114.99 8.3 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.581 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.1 Cg_exo -45.69 -12.44 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 CA-C-N 120.316 1.148 . . . . 0.0 111.449 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.572 ' N ' ' O ' ' B' ' 569' ' ' HIS . 11.9 mt-10 -96.51 -52.73 3.84 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 122.001 0.905 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.439 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 19.1 m170 -57.61 -4.29 0.25 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.897 -1.127 . . . . 0.0 109.886 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.496 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.7 t80 -127.34 55.04 1.62 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 17.1 m -94.48 177.73 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.802 0.81 . . . . 0.0 111.116 -178.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.441 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.19 143.42 29.63 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.408 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . 0.453 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -92.98 75.56 4.76 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 116.769 -1.972 . . . . 0.0 109.589 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -153.29 -54.51 0.11 Allowed 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 102.599 -3.112 . . . . 0.0 102.599 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.529 ' O ' ' N ' ' B' ' 580' ' ' LYS . 23.8 p -127.57 78.89 1.85 Allowed 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 111.567 -2.561 . . . . 0.0 104.253 177.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.5 mt -53.14 15.55 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.84 -37.13 18.03 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 119.735 -1.853 . . . . 0.0 112.122 -178.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.581 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.8 tp60 -159.65 140.89 12.69 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 119.636 -1.915 . . . . 0.0 114.466 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.441 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 23.0 tp -136.34 170.68 15.64 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.434 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.2 m-20 -144.94 128.47 17.03 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.277 -0.89 . . . . 0.0 109.143 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -15.99 0.8 Allowed 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.43 -0.794 . . . . 0.0 109.625 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.17 -21.05 50.98 Favored Glycine 0 N--CA 1.485 1.91 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -133.73 28.91 3.89 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.576 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.7 OUTLIER -89.94 108.98 20.04 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.489 1.137 . . . . 0.0 110.115 -179.692 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.5 160.0 14.81 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.8 tt0 -154.82 157.0 37.24 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 122.584 1.183 . . . . 0.0 111.115 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.452 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 2.9 pt20 -156.65 146.04 20.57 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 177.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.668 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.88 23.8 0.74 Allowed 'General case' 0 C--N 1.289 -2.048 0 O-C-N 121.29 -0.881 . . . . 0.0 109.465 -178.656 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.6 m-20 82.93 -7.06 1.23 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.791 -0.568 . . . . 0.0 111.661 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.7 mttm -86.01 116.22 64.87 Favored Pre-proline 0 C--N 1.293 -1.867 0 O-C-N 121.042 -1.036 . . . . 0.0 110.723 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.471 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.4 Cg_exo -52.57 162.84 2.09 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 CA-C-N 119.919 1.007 . . . . 0.0 112.328 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.471 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 20.1 m-85 -171.27 143.63 1.9 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.247 -0.908 . . . . 0.0 110.289 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.4 m -75.29 153.87 37.7 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 173.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.462 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -56.97 -57.13 13.87 Favored 'General case' 0 C--N 1.289 -2.036 0 C-N-CA 117.475 -1.69 . . . . 0.0 106.813 179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.27 -28.77 1.38 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.48 -0.763 . . . . 0.0 109.6 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 80.1 m -82.76 -61.08 1.97 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.312 -0.867 . . . . 0.0 109.039 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.45 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 1.1 t80 -55.45 -55.33 32.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.535 -0.728 . . . . 0.0 109.582 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.464 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.21 -42.83 31.16 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.209 -0.932 . . . . 0.0 109.14 -178.939 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -56.34 -23.85 40.01 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.215 -0.928 . . . . 0.0 110.002 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 4.6 mt -89.16 -56.9 3.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.921 -1.112 . . . . 0.0 111.303 -178.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.496 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 16.7 m-85 -109.99 -25.72 10.11 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.262 -0.899 . . . . 0.0 110.59 -178.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.496 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.0 p . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.056 -1.028 . . . . 0.0 109.949 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.6 ttt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.49 -55.72 0.14 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.086 -1.009 . . . . 0.0 108.592 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.428 ' O ' ' N ' ' A' ' 5' ' ' GLY . 74.8 mt -46.0 -84.73 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 122.158 0.98 . . . . 0.0 109.528 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 27.7 t70 45.88 21.86 0.11 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-O 121.846 0.831 . . . . 0.0 109.308 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.428 ' N ' ' O ' ' A' ' 3' ' ' LEU . . . -64.49 -14.49 57.51 Favored Glycine 0 N--CA 1.486 2.03 0 N-CA-C 108.07 -2.012 . . . . 0.0 108.07 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.533 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -108.72 -99.66 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -179.143 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.584 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -153.03 -98.43 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 O-C-N 120.804 -1.185 . . . . 0.0 109.768 -179.568 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.584 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -144.78 -62.61 0.02 OUTLIER Pre-proline 0 N--CA 1.501 2.08 0 O-C-N 120.98 -1.075 . . . . 0.0 110.572 -179.275 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' O ' ' CD1' ' A' ' 13' ' ' TYR . 63.2 Cg_exo -44.45 -34.64 7.77 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 CA-C-N 121.16 1.45 . . . . 0.0 109.975 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.42 ' OD2' ' OH ' ' A' ' 13' ' ' TYR . 35.4 t0 -113.07 -25.7 8.82 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.166 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.76 8.65 78.89 Favored Glycine 0 N--CA 1.487 2.091 0 N-CA-C 109.412 -1.475 . . . . 0.0 109.412 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 8' ' ' MET . 12.8 t -164.17 -35.19 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.217 -1.166 . . . . 0.0 110.541 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.526 ' O ' ' CB ' ' A' ' 14' ' ' ALA . 43.3 m-85 54.15 -96.37 0.06 Allowed 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 -178.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.526 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 160.35 -36.97 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -161.14 4.85 0.07 Allowed 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.458 -0.776 . . . . 0.0 110.048 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.459 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 73.48 36.69 54.25 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 108.51 -1.836 . . . . 0.0 108.51 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.7 t -90.18 123.23 33.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.57 -0.959 . . . . 0.0 109.907 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.459 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -134.61 123.33 23.63 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.94 130.12 37.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.135 -0.978 . . . . 0.0 109.136 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.456 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -84.09 134.27 34.61 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.74 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -78.14 145.74 35.5 Favored 'General case' 0 C--N 1.297 -1.694 0 O-C-N 121.296 -0.877 . . . . 0.0 109.77 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 36.7 t -136.73 105.37 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.926 0.87 . . . . 0.0 109.767 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -78.72 104.86 9.62 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.549 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -71.95 100.61 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 O-C-N 121.336 -0.852 . . . . 0.0 110.077 -178.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.586 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -76.07 177.0 7.44 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 178.83 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.9 t70 56.8 6.57 0.31 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.727 -1.233 . . . . 0.0 107.918 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.586 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.8 mt -149.27 -37.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 77.25 15.97 1.72 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.521 178.402 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -91.17 -178.97 5.31 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.613 -1.304 . . . . 0.0 108.635 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -140.74 116.93 10.6 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.1 t -119.02 157.43 20.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-O 121.56 0.695 . . . . 0.0 109.792 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.43 134.6 43.81 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -114.3 114.13 25.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.6 -0.687 . . . . 0.0 109.398 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.436 ' HE ' ' HB3' ' A' ' 19' ' ' GLU . 1.3 tpp85 -57.84 108.52 0.59 Allowed 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.7 m -137.45 -169.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 122.062 0.934 . . . . 0.0 110.352 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.42 ' H ' HG11 ' A' ' 39' ' ' VAL . 11.3 p -141.81 174.42 10.59 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.442 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -81.48 47.29 3.59 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -150.77 4.33 0.49 Allowed 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.737 -0.861 . . . . 0.0 108.994 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.42 HG11 ' H ' ' A' ' 36' ' ' THR . 2.5 m -86.01 143.35 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 120.914 -1.116 . . . . 0.0 109.846 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.503 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -78.56 146.36 34.3 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 179.446 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.52 ' C ' ' H ' ' A' ' 43' ' ' GLY . 97.3 mt -49.57 -56.33 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.053 -1.029 . . . . 0.0 108.828 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.45 -9.56 3.47 Favored Glycine 0 N--CA 1.485 1.912 0 N-CA-C 108.089 -2.004 . . . . 0.0 108.089 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.52 ' H ' ' C ' ' A' ' 41' ' ' ILE . . . -73.73 -28.0 66.01 Favored Glycine 0 N--CA 1.484 1.878 0 N-CA-C 107.611 -2.196 . . . . 0.0 107.611 178.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.38 -41.41 16.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 41.5 mtm -48.43 -36.67 15.35 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -71.57 -66.03 0.68 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.391 0.615 . . . . 0.0 110.096 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.401 ' O ' ' C ' ' A' ' 48' ' ' LEU . 47.0 mttm -53.37 -55.78 22.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.306 -0.871 . . . . 0.0 110.666 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -45.83 -58.45 3.5 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.924 -1.11 . . . . 0.0 109.004 -179.254 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.513 ' O ' ' N ' ' A' ' 52' ' ' LEU . 73.2 t -57.29 -48.26 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.752 -0.592 . . . . 0.0 110.25 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -44.7 -40.04 5.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.081 -1.012 . . . . 0.0 109.512 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.508 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -70.7 -26.37 63.38 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.457 -0.777 . . . . 0.0 109.446 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.6 tp -80.04 -75.05 0.27 Allowed 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.338 -0.851 . . . . 0.0 108.801 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 t70 71.4 83.13 0.14 Allowed 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.835 0.826 . . . . 0.0 110.6 178.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.603 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -170.26 151.84 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.0 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.354 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.46 30.71 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 109.379 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.603 ' H ' ' C ' ' A' ' 54' ' ' VAL . 49.7 tttm -77.73 171.58 14.73 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.011 -1.055 . . . . 0.0 108.413 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.497 ' N ' ' OD1' ' A' ' 57' ' ' ASP . 0.6 OUTLIER -92.67 90.7 7.2 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 120.974 -1.079 . . . . 0.0 109.509 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.448 ' O ' ' O ' ' A' ' 61' ' ' HIS . 2.3 m0 -76.59 -51.56 11.4 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.177 -0.952 . . . . 0.0 108.529 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.52 ' HG ' ' H ' ' A' ' 60' ' ' ASP . 71.8 p -41.51 -56.14 2.63 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.312 0.577 . . . . 0.0 110.406 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.52 ' H ' ' HG ' ' A' ' 59' ' ' SER . 10.5 t0 -52.25 -40.5 61.78 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' O ' ' A' ' 58' ' ' TRP . 16.0 m170 -85.0 123.13 30.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.81 0.814 . . . . 0.0 110.324 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.16 -179.98 5.66 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.573 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.29 143.03 26.74 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.868 -1.145 . . . . 0.0 109.857 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.536 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -130.34 151.7 50.56 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.264 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -110.62 94.55 5.06 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.104 -0.998 . . . . 0.0 108.641 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.418 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 8.5 pt-20 -56.12 -23.55 35.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.245 -0.91 . . . . 0.0 110.813 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.512 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.7 mmtp -68.43 -9.64 49.94 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.1 mmtt -133.1 -12.17 2.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.915 -178.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.67 46.15 27.27 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -178.151 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -113.61 -173.5 2.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.612 0.72 . . . . 0.0 110.126 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.57 102.44 7.37 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 35.6 mt -61.9 86.57 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.325 0 O-C-N 120.504 -1.373 . . . . 0.0 110.548 -176.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.2 pp -120.99 10.88 10.89 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -87.07 36.33 0.73 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 21.6 m -46.01 -14.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.223 -0.923 . . . . 0.0 110.058 -179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.604 ' HD1' ' H ' ' A' ' 76' ' ' HIS . 8.4 m80 -62.63 -29.03 70.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.136 -0.977 . . . . 0.0 109.249 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 77.1 m95 -104.17 -155.26 0.53 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.438 -0.789 . . . . 0.0 109.406 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.612 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -144.44 171.29 14.56 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.165 0.983 . . . . 0.0 109.386 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.472 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 7.7 mp -48.11 -62.34 1.52 Allowed 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.127 0.965 . . . . 0.0 108.515 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -45.94 -52.01 12.33 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.874 0.845 . . . . 0.0 110.085 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.612 ' CG ' ' H ' ' A' ' 78' ' ' THR . 31.7 mmtt -45.13 -55.58 5.57 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 121.552 0.691 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.09 -41.86 63.61 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.979 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 121.65 7.08 8.3 Favored Glycine 0 N--CA 1.499 2.89 0 N-CA-C 108.844 -1.703 . . . . 0.0 108.844 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.532 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 50.5 mt -62.33 161.04 2.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.486 -1.008 . . . . 0.0 109.282 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.532 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.18 -164.63 0.36 Allowed 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.0 -24.29 62.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.403 -0.811 . . . . 0.0 109.694 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 88' ' ' ALA . 28.1 p30 -76.26 -11.46 59.92 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.267 -0.896 . . . . 0.0 108.67 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.456 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.55 113.52 25.97 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -94.46 117.14 29.67 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.106 -0.996 . . . . 0.0 109.773 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.5 mt -93.84 176.52 6.32 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.466 0.65 . . . . 0.0 109.25 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.536 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.6 mt-30 -133.34 167.73 19.88 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.441 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 25.0 t80 -124.01 99.0 6.04 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.55 160.09 39.7 Favored Pre-proline 0 N--CA 1.502 2.154 0 O-C-N 121.356 -0.84 . . . . 0.0 111.037 -176.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . 0.425 ' O ' ' O ' ' A' ' 60' ' ' ASP . 43.1 Cg_exo . . . . . 0 N--CA 1.489 1.207 0 C-N-CA 123.574 2.849 . . . . 0.0 112.796 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 6.8 m80 -54.68 -178.72 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.22 -0.925 . . . . 0.0 109.508 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -159.97 2.03 0.08 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.365 -0.835 . . . . 0.0 110.37 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.402 ' H ' ' HD3' ' B' ' 544' ' ' ARG . 0.1 OUTLIER -77.42 -9.63 58.99 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.028 -1.045 . . . . 0.0 109.798 -179.617 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.24 -154.66 0.46 Allowed 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . 163.85 -88.42 0.1 Allowed Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.733 -1.222 . . . . 0.0 110.203 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m -169.36 120.01 0.7 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.235 -1.156 . . . . 0.0 108.19 -179.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.06 135.17 57.63 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 120.811 -1.181 . . . . 0.0 110.513 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.69 104.15 13.57 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.1 t -51.46 127.19 19.32 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.24 1.019 . . . . 0.0 109.674 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.7 -34.54 5.41 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 10.8 m -105.75 -35.97 7.2 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.429 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.7 mm-40 55.3 56.4 6.44 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.682 1.23 . . . . 0.0 109.997 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -140.79 124.08 10.07 Favored Pre-proline 0 C--N 1.294 -1.815 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -44.14 135.15 8.45 Favored 'Trans proline' 0 N--CA 1.491 1.376 0 CA-C-N 120.433 1.19 . . . . 0.0 114.842 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.0 mt -93.83 98.41 8.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.427 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.2 p -98.97 91.34 4.99 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.191 -0.943 . . . . 0.0 111.349 -177.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.0 -96.76 0.16 Allowed Glycine 0 N--CA 1.487 2.07 0 N-CA-C 107.579 -2.209 . . . . 0.0 107.579 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.486 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.2 mmt-85 -111.77 151.95 28.4 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 23.7 p -144.57 126.45 15.35 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.902 -1.124 . . . . 0.0 111.512 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 44.8 mt -90.75 146.06 6.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.8 m -118.8 146.53 44.75 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.847 0.832 . . . . 0.0 109.009 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.726 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -129.29 0.26 Allowed 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.598 0.713 . . . . 0.0 109.287 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 3.1 mtt -66.29 26.69 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.726 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.27 -9.06 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.63 159.41 24.03 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . 0.404 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 16.9 mmmt -102.55 174.67 5.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 2.5 m-85 -160.29 132.85 6.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.236 -1.386 . . . . 0.0 110.225 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.532 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.6 m80 -53.88 113.81 5.51 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.597 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.88 -12.53 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.535 0 CA-C-N 120.458 1.199 . . . . 0.0 110.731 -178.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' B' ' 569' ' ' HIS . 7.5 mt-10 -91.86 -51.81 5.04 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 122.076 0.941 . . . . 0.0 110.243 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.481 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -61.48 -3.22 0.92 Allowed 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.168 -0.957 . . . . 0.0 109.896 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.1 t80 -132.19 59.21 1.72 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 17.9 m -94.59 177.76 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.931 0.872 . . . . 0.0 111.518 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.451 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.92 145.52 27.73 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.505 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.64 76.22 3.26 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 116.843 -1.943 . . . . 0.0 109.844 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -152.68 -52.48 0.11 Allowed 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 102.191 -3.263 . . . . 0.0 102.191 173.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.0 p -129.63 80.11 1.94 Allowed 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 111.437 -2.62 . . . . 0.0 104.47 176.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mt -52.43 16.11 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.836 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.52 -36.87 17.37 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 119.632 -1.917 . . . . 0.0 112.551 -178.673 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.05 140.14 12.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 119.611 -1.93 . . . . 0.0 114.653 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.451 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 22.2 tp -137.11 169.54 17.6 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.1 m-20 -147.09 131.24 17.35 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.313 -0.867 . . . . 0.0 109.229 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -52.58 -21.89 4.37 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.443 -0.785 . . . . 0.0 109.476 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.64 -17.31 64.13 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.64 26.95 3.38 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.82 108.51 19.74 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 122.729 1.252 . . . . 0.0 110.06 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.531 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.99 167.88 9.55 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.424 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.5 tt0 -153.15 156.3 38.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.808 -1.183 . . . . 0.0 110.373 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.528 ' CD ' HD22 ' B' ' 591' ' ' ASN . 7.8 tt0 -157.96 146.68 19.21 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 178.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.666 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 50.08 21.99 0.84 Allowed 'General case' 0 C--N 1.29 -1.997 0 O-C-N 121.182 -0.949 . . . . 0.0 109.26 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.1 m-20 81.2 -4.99 1.66 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.786 -0.571 . . . . 0.0 110.716 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . 0.412 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 33.4 mttm -91.36 118.98 68.77 Favored Pre-proline 0 C--N 1.295 -1.795 0 O-C-N 121.258 -0.901 . . . . 0.0 109.575 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.0 Cg_exo -49.23 166.44 0.18 Allowed 'Trans proline' 0 N--CA 1.488 1.171 0 CA-C-N 120.135 1.084 . . . . 0.0 111.494 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' B' ' 588' ' ' LYS . 21.9 m-85 -170.55 137.3 1.36 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.08 -1.012 . . . . 0.0 110.756 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 16.3 m -69.55 154.28 42.23 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 173.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.457 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.81 -56.68 19.04 Favored 'General case' 0 C--N 1.289 -2.046 0 C-N-CA 117.479 -1.689 . . . . 0.0 106.459 179.516 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -45.53 -26.53 0.6 Allowed 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.587 -0.696 . . . . 0.0 109.845 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 93.4 m -84.48 -65.4 1.01 Allowed 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.155 -0.965 . . . . 0.0 109.31 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -51.27 -56.66 11.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.497 -0.752 . . . . 0.0 109.38 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.472 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.31 -42.47 31.12 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.262 -0.898 . . . . 0.0 109.064 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -58.8 -20.27 48.64 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.366 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.87 -56.44 3.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.751 -1.218 . . . . 0.0 110.779 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.41 ' O ' ' C ' ' B' ' 605' ' ' CYS . 9.5 m-85 -107.43 32.35 4.74 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.414 -0.804 . . . . 0.0 109.924 -178.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.41 ' C ' ' O ' ' B' ' 604' ' ' PHE . 9.4 t . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.924 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.643 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.643 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -150.93 -42.31 0.12 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.825 -1.172 . . . . 0.0 108.74 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.618 ' CD1' ' H ' ' A' ' 3' ' ' LEU . 5.8 mp -55.86 -66.49 0.41 Allowed 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 122.206 1.003 . . . . 0.0 109.242 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.409 ' C ' ' N ' ' A' ' 6' ' ' ILE . 22.9 t70 -73.87 14.37 0.4 Allowed 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.051 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.496 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -60.93 -13.74 34.95 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 107.402 -2.279 . . . . 0.0 107.402 179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.572 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -116.13 -95.37 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.606 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -153.03 -98.67 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.181 -0.949 . . . . 0.0 109.758 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.606 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -146.32 -64.49 0.02 OUTLIER Pre-proline 0 N--CA 1.499 1.99 0 O-C-N 121.022 -1.049 . . . . 0.0 110.575 -179.192 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo -46.37 -28.54 6.03 Favored 'Trans proline' 0 N--CA 1.494 1.513 0 CA-C-N 121.756 1.663 . . . . 0.0 109.946 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -115.79 -26.41 7.4 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -93.6 9.06 74.2 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.605 ' N ' ' O ' ' A' ' 8' ' ' MET . 39.4 t -157.71 -102.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.585 -0.95 . . . . 0.0 109.387 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.568 ' CG ' ' O ' ' A' ' 12' ' ' CYS . 26.3 m-85 -169.25 -104.15 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.358 -0.839 . . . . 0.0 108.872 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -179.06 -41.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -142.6 2.62 1.42 Allowed 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.22 21.71 69.72 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 108.804 -1.718 . . . . 0.0 108.804 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -95.7 122.53 38.56 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.471 -1.017 . . . . 0.0 109.802 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.578 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -131.27 120.93 23.89 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.539 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.26 129.37 35.81 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.162 -0.961 . . . . 0.0 109.215 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.474 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.79 134.42 34.73 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.183 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.22 146.24 35.05 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.272 -0.893 . . . . 0.0 109.794 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -138.51 105.44 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 CA-C-O 121.786 0.803 . . . . 0.0 110.059 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.494 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 2.8 m80 -79.59 104.75 10.41 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -71.11 98.21 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.258 -0.901 . . . . 0.0 109.915 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -70.03 164.28 24.34 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.9 t70 72.09 -43.65 0.57 Allowed 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.543 ' H ' ' C ' ' A' ' 25' ' ' THR . 4.8 mt -93.25 -30.77 15.01 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.565 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 73.31 17.45 3.93 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.085 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtp85 -94.27 -178.73 4.7 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.899 -1.126 . . . . 0.0 109.142 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.494 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 9.9 m-20 -140.18 117.8 11.57 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.1 t -120.7 157.76 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.653 0.739 . . . . 0.0 110.013 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.06 135.36 45.3 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -113.53 111.59 22.15 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.511 -0.743 . . . . 0.0 109.322 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -61.11 102.45 0.21 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.9 m -129.95 -169.16 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 CA-C-O 121.936 0.874 . . . . 0.0 109.969 -178.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.429 ' C ' ' H ' ' A' ' 38' ' ' GLU . 16.7 p -139.32 169.59 17.49 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.578 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -77.13 44.66 2.17 Favored Glycine 0 N--CA 1.485 1.943 0 C-N-CA 119.386 -1.387 . . . . 0.0 109.634 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.429 ' H ' ' C ' ' A' ' 36' ' ' THR . 3.9 pt-20 -146.61 4.04 0.87 Allowed 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.608 -0.936 . . . . 0.0 108.795 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.9 m -88.17 137.19 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.67 179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.8 m80 -76.1 146.78 39.08 Favored 'General case' 0 C--N 1.293 -1.865 0 O-C-N 120.942 -1.099 . . . . 0.0 108.689 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.414 HG21 HD11 ' A' ' 41' ' ' ILE . 97.7 mt -45.93 -58.64 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.964 . . . . 0.0 109.583 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.8 -16.82 8.08 Favored Glycine 0 C--N 1.297 -1.602 0 N-CA-C 108.496 -1.841 . . . . 0.0 108.496 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -69.34 -29.17 71.94 Favored Glycine 0 N--CA 1.483 1.772 0 N-CA-C 107.941 -2.063 . . . . 0.0 107.941 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 t -84.79 -39.81 14.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.49 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.0 mtm -46.68 -37.67 8.68 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.522 ' CG ' ' HH ' ' B' ' 595' ' ' TYR . 0.6 OUTLIER -78.22 -56.94 4.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.711 -0.618 . . . . 0.0 110.641 -178.514 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -53.03 -59.85 4.03 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.794 -1.191 . . . . 0.0 110.738 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.68 -44.92 13.84 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.153 -0.967 . . . . 0.0 109.364 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 39.9 t -68.27 -48.01 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.514 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -45.08 -39.24 5.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 0.0 109.866 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.535 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.7 mtmp? -75.93 -28.38 57.98 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.347 -0.846 . . . . 0.0 110.447 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.409 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 11.1 tp -60.99 -65.93 0.61 Allowed 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.084 -1.01 . . . . 0.0 108.878 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.2 t70 75.53 77.95 0.1 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.909 0.862 . . . . 0.0 110.422 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.567 ' C ' ' H ' ' A' ' 56' ' ' LYS . 3.0 p -175.05 126.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.007 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.1 tptt -65.0 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 109.873 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.567 ' H ' ' C ' ' A' ' 54' ' ' VAL . 4.5 ttpm? -77.66 161.23 27.94 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.041 -1.037 . . . . 0.0 108.701 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.418 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -66.71 93.37 0.25 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.296 -0.877 . . . . 0.0 109.38 -179.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.528 ' CZ2' ' O ' ' A' ' 54' ' ' VAL . 16.7 m0 -83.77 -46.49 12.17 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.839 0.828 . . . . 0.0 109.029 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.8 m -42.69 -55.19 3.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.299 -0.876 . . . . 0.0 110.47 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.42 ' OD1' ' O ' ' A' ' 94' ' ' PRO . 12.5 t0 -50.5 -23.35 2.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.407 -0.808 . . . . 0.0 110.215 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.467 ' CB ' ' CZ ' ' A' ' 92' ' ' PHE . 21.9 m-70 -90.89 160.05 15.9 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.998 -1.064 . . . . 0.0 111.864 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.26 170.56 13.07 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -94.36 146.23 24.2 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.6 -1.313 . . . . 0.0 110.07 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.577 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -129.86 151.57 50.29 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.07 93.77 4.65 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.108 -0.995 . . . . 0.0 108.782 -179.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -55.48 -23.83 27.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.29 -0.881 . . . . 0.0 110.771 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.496 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.9 mmtp -67.51 -10.14 48.86 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 178.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -133.48 -12.04 2.74 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.984 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.5 mpp_? 52.28 46.18 27.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 -178.088 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -114.01 -171.15 1.85 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.607 0.717 . . . . 0.0 110.071 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.452 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -126.1 103.64 7.82 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 177.357 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.02 86.84 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.27 0 O-C-N 120.507 -1.371 . . . . 0.0 111.15 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.37 9.31 10.32 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.499 ' C ' ' H ' ' A' ' 76' ' ' HIS . 5.6 mmpt? -77.65 54.18 1.18 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.679 -0.638 . . . . 0.0 110.029 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.1 p -59.13 -5.99 0.79 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.864 -1.147 . . . . 0.0 108.769 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.499 ' H ' ' C ' ' A' ' 74' ' ' LYS . 36.1 m80 -59.41 -40.78 87.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.519 -0.738 . . . . 0.0 110.971 -179.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -121.18 -162.46 0.97 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.557 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -120.24 -164.17 1.07 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.973 -1.079 . . . . 0.0 110.481 -178.257 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.539 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.1 mp -71.63 -59.26 2.85 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -47.01 -52.67 14.26 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.018 0.914 . . . . 0.0 109.72 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.557 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.4 mmtt -45.31 -55.06 6.33 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.674 0.75 . . . . 0.0 109.664 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -71.35 -43.62 66.61 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.256 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.37 4.21 8.38 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 108.819 -1.713 . . . . 0.0 108.819 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.52 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 38.4 mt -61.69 161.05 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 O-C-N 121.582 -0.952 . . . . 0.0 109.35 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -172.13 -161.96 0.19 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.361 -0.837 . . . . 0.0 109.143 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.83 -23.98 60.84 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.504 -0.748 . . . . 0.0 109.482 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -74.5 -11.92 60.35 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.474 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.46 113.15 25.34 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.9 mmtp -94.78 118.12 31.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.911 -1.118 . . . . 0.0 109.69 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.0 mt -94.41 175.99 6.47 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.561 0.696 . . . . 0.0 109.332 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.577 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -134.87 161.38 35.4 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 61.8 t80 -120.42 91.23 3.49 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -110.06 162.03 22.05 Favored Pre-proline 0 N--CA 1.507 2.386 0 O-C-N 121.848 -0.533 . . . . 0.0 110.291 -177.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . 0.42 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 37.4 Cg_endo . . . . . 0 N--CA 1.497 1.73 0 C-N-CA 122.915 2.41 . . . . 0.0 111.77 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . 0.518 ' CD2' ' O ' ' B' ' 541' ' ' TYR . 73.2 t80 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -60.93 -168.26 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.192 -0.943 . . . . 0.0 109.663 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.94 -35.13 10.17 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.526 ' CG ' HH21 ' B' ' 544' ' ' ARG . 0.2 OUTLIER -57.15 127.92 34.36 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.45 -0.781 . . . . 0.0 109.641 -179.906 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.483 ' HG2' HH21 ' B' ' 545' ' ' ARG . 1.0 OUTLIER -73.38 -148.75 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.289 0 O-C-N 121.166 -0.959 . . . . 0.0 109.58 179.875 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . 176.41 -108.54 0.26 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.533 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m -162.29 116.45 1.82 Allowed 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -58.13 134.4 56.43 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 120.942 -1.099 . . . . 0.0 110.713 -178.005 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.8 104.0 12.71 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.866 -1.901 . . . . 0.0 105.866 178.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.0 t -48.7 124.75 8.86 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 122.034 0.921 . . . . 0.0 109.318 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 110.23 -37.21 3.86 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.8 m -101.86 -35.99 8.82 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.418 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 55.35 56.41 6.4 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.815 1.293 . . . . 0.0 109.427 -178.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -140.45 122.44 9.61 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.23 133.46 9.02 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 CA-C-N 120.539 1.228 . . . . 0.0 114.504 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.533 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -92.04 98.15 8.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.66 91.14 4.73 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.992 0.901 . . . . 0.0 111.238 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.07 -96.36 0.15 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 107.283 -2.327 . . . . 0.0 107.283 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.475 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.8 mmt-85 -112.39 149.86 31.92 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -145.04 126.64 15.11 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.911 -1.118 . . . . 0.0 111.521 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 43.0 mt -91.4 146.41 6.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.6 m -120.13 146.39 46.01 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.873 0.844 . . . . 0.0 108.945 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.752 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.74 -129.22 0.26 Allowed 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.551 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.88 25.94 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 109.245 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.752 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.99 -8.13 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -178.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 150.63 28.11 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . 0.414 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 18.2 mmmt -96.49 174.72 6.71 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . 0.414 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 0.9 OUTLIER -162.27 132.07 4.58 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 117.568 -1.653 . . . . 0.0 111.31 -178.607 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.592 ' O ' ' N ' ' B' ' 571' ' ' GLU . 2.6 m80 -50.59 112.27 2.76 Favored Pre-proline 0 C--N 1.297 -1.687 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 176.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.461 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 51.1 Cg_exo -44.62 -4.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.415 0 CA-C-N 120.186 1.102 . . . . 0.0 114.395 -178.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.592 ' N ' ' O ' ' B' ' 569' ' ' HIS . 5.8 mt-10 -112.16 -53.66 2.69 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 122.749 1.261 . . . . 0.0 108.814 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -46.78 -15.15 0.03 OUTLIER 'General case' 0 C--N 1.285 -2.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.453 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.519 ' N ' ' O ' ' B' ' 571' ' ' GLU . 55.1 t80 -118.53 54.08 0.96 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . 0.438 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 14.1 m -91.83 176.13 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.464 ' CB ' ' SG ' ' B' ' 596' ' ' CYS . 0.0 OUTLIER -71.39 141.2 50.35 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . 0.49 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.87 74.88 6.48 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 116.377 -2.129 . . . . 0.0 108.486 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -150.85 -60.58 0.18 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 100.839 -3.763 . . . . 0.0 100.839 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.6 OUTLIER -104.8 155.28 19.04 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 176.156 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . 0.67 ' H ' ' CD2' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -105.55 14.21 28.88 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.033 -1.042 . . . . 0.0 111.265 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -102.86 -38.99 7.16 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.461 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.1 tp60 -162.42 142.0 9.46 Favored 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 122.447 2.385 . . . . 0.0 115.979 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.453 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 22.7 tp -137.41 168.4 19.72 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 174.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.8 m-20 -150.54 133.85 16.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.859 -1.15 . . . . 0.0 109.843 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -50.39 -18.85 0.7 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.563 0.697 . . . . 0.0 109.697 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.76 -21.26 51.33 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 586' ' ' THR . . . . . 0.449 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.5 p -134.62 26.79 3.71 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.58 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.65 108.37 19.77 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 122.589 1.185 . . . . 0.0 110.256 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.73 169.85 8.37 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.063 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.422 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.7 tt0 -151.34 157.19 42.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.653 -1.279 . . . . 0.0 110.832 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.621 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.7 OUTLIER -153.22 146.07 24.42 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.527 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.03 23.54 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.057 -1.027 . . . . 0.0 110.064 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.487 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.2 m-20 82.66 -4.82 1.35 Allowed 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.811 -0.556 . . . . 0.0 110.702 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 39.1 mttm -91.57 124.54 60.54 Favored Pre-proline 0 C--N 1.295 -1.787 0 O-C-N 121.302 -0.874 . . . . 0.0 109.698 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.492 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.8 Cg_exo -49.09 163.64 0.32 Allowed 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 119.971 1.025 . . . . 0.0 112.479 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.522 ' HH ' ' CG ' ' A' ' 46' ' ' LEU . 13.5 m-85 -170.73 141.69 1.86 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.335 -0.853 . . . . 0.0 109.796 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . 0.464 ' SG ' ' CB ' ' B' ' 575' ' ' CYS . 6.0 m -74.49 157.05 36.23 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.439 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.83 -57.31 13.21 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 179.1 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.56 -30.18 2.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.454 -0.778 . . . . 0.0 108.936 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 8.6 m -79.43 -62.56 1.65 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.545 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.3 OUTLIER -56.73 -55.96 27.51 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-O 121.15 0.5 . . . . 0.0 110.585 -179.685 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.545 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -47.66 -42.16 23.96 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.228 -0.92 . . . . 0.0 109.091 -178.566 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 28.3 tttt -59.67 -20.9 59.27 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.187 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 6.6 mt -90.6 -56.74 3.08 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.131 -0.98 . . . . 0.0 111.509 -178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.621 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.2 m-85 -89.37 30.64 0.97 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.874 -1.141 . . . . 0.0 110.396 -178.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.503 ' SG ' ' O ' ' B' ' 601' ' ' LEU . 3.2 m . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.912 -1.117 . . . . 0.0 109.291 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 ttt . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.74 -56.05 0.2 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.014 -1.054 . . . . 0.0 108.619 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 74.6 mt -44.92 -85.15 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 122.055 0.931 . . . . 0.0 109.487 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.4 t0 46.38 24.19 0.27 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 121.845 0.831 . . . . 0.0 109.337 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.09 -14.14 58.67 Favored Glycine 0 N--CA 1.487 2.037 0 N-CA-C 108.129 -1.989 . . . . 0.0 108.129 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.52 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -110.53 -98.86 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.667 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.136 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.583 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -152.2 -98.42 0.05 Allowed 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.94 -1.1 . . . . 0.0 109.595 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.583 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -145.45 -62.69 0.02 OUTLIER Pre-proline 0 N--CA 1.499 2.017 0 O-C-N 120.974 -1.079 . . . . 0.0 110.74 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -43.44 -32.56 3.63 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 CA-C-N 121.166 1.452 . . . . 0.0 110.091 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -117.04 -24.07 7.72 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.064 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.34 4.11 84.13 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.945 -1.262 . . . . 0.0 109.945 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.52 ' N ' ' O ' ' A' ' 8' ' ' MET . 17.5 t -167.68 -25.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.026 -1.279 . . . . 0.0 111.043 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 54.22 -127.92 2.31 Favored 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -171.35 -39.0 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.02 -1.05 . . . . 0.0 109.782 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -157.59 9.03 0.17 Allowed 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.209 -0.932 . . . . 0.0 110.044 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 80.97 42.29 9.73 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 108.168 -1.973 . . . . 0.0 108.168 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.632 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 12.4 p -79.45 129.62 34.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.481 -1.011 . . . . 0.0 109.648 -179.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.548 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -153.04 137.67 16.88 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -90.38 132.3 35.68 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.014 -1.053 . . . . 0.0 110.1 -179.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.524 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.42 134.2 34.48 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.27 145.73 35.25 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.169 -0.957 . . . . 0.0 108.69 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.2 t -138.51 106.7 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-O 121.78 0.8 . . . . 0.0 110.193 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.521 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 16.4 m170 -82.11 103.97 12.11 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.543 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -73.97 108.61 5.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 118.654 -1.219 . . . . 0.0 108.22 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.89 -23.46 38.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 109.057 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -78.84 -8.33 58.71 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.1 mt -130.15 -21.06 2.99 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.543 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.98 12.55 2.26 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 122.033 -0.417 . . . . 0.0 110.143 -179.579 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 16.5 mtp-105 -98.3 -178.12 3.93 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 121.03 -1.044 . . . . 0.0 109.856 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.521 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 20.3 m-20 -135.97 116.68 13.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.6 t -115.93 158.04 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-O 121.626 0.727 . . . . 0.0 109.772 -179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.72 131.05 40.81 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -115.45 118.11 32.26 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.632 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -60.41 139.59 57.61 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 178.459 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.421 ' CG1' ' O ' ' A' ' 34' ' ' ARG . 5.5 m -160.26 -175.16 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.443 0 CA-C-O 121.882 0.849 . . . . 0.0 109.741 -177.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 15.1 p -140.49 173.05 11.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.97 49.74 4.02 Favored Glycine 0 C--N 1.29 -2.009 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -153.5 1.69 0.26 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.76 -0.847 . . . . 0.0 109.356 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -85.8 151.41 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.717 -1.239 . . . . 0.0 108.303 179.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.569 ' CD2' ' H ' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -87.67 142.75 27.59 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 121.235 -0.916 . . . . 0.0 109.17 179.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.464 ' C ' ' H ' ' A' ' 43' ' ' GLY . 38.6 mt -47.16 -57.81 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-O 122.179 0.99 . . . . 0.0 109.222 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.69 -14.36 3.71 Favored Glycine 0 C--N 1.295 -1.733 0 N-CA-C 108.512 -1.835 . . . . 0.0 108.512 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.79 -25.48 62.48 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -79.58 -55.09 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.413 -1.051 . . . . 0.0 109.757 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -21.95 4.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.449 -1.407 . . . . 0.0 108.585 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tt -71.69 -58.32 3.59 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -61.76 -51.87 66.56 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.306 -0.871 . . . . 0.0 110.625 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.3 tp -44.82 -54.24 6.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.089 -1.007 . . . . 0.0 110.604 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.88 -44.06 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 120.722 -1.236 . . . . 0.0 110.098 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -45.01 -38.45 4.81 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.125 -0.985 . . . . 0.0 109.986 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.532 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.3 mtmp? -67.91 -48.5 65.81 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.381 -0.824 . . . . 0.0 110.421 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.8 OUTLIER -65.0 -68.11 0.39 Allowed 'General case' 0 C--N 1.307 -1.262 0 O-C-N 120.877 -1.139 . . . . 0.0 108.33 179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 10.2 t0 80.36 88.23 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.119 0.962 . . . . 0.0 110.377 178.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.523 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -169.78 140.12 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.285 -2.223 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.276 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -67.32 35.54 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.639 -0.663 . . . . 0.0 110.567 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.523 ' H ' ' C ' ' A' ' 54' ' ' VAL . 13.6 ttmm -78.81 144.9 34.64 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 118.385 -1.326 . . . . 0.0 108.85 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.526 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 4.4 m-20 -54.73 96.11 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.628 -0.67 . . . . 0.0 110.073 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.477 ' O ' ' N ' ' A' ' 61' ' ' HIS . 47.6 m95 -107.21 -29.64 9.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.329 -0.857 . . . . 0.0 109.612 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 p -44.33 -42.89 7.11 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.617 -0.677 . . . . 0.0 110.149 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 15.7 t0 -75.1 -15.87 60.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.385 -0.822 . . . . 0.0 109.621 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.526 ' CE1' ' O ' ' A' ' 57' ' ' ASP . 2.4 m80 -85.18 128.36 34.64 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.209 -0.932 . . . . 0.0 110.789 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -139.3 176.82 8.38 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.576 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.7 mm? -94.75 145.12 25.09 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.818 -1.176 . . . . 0.0 110.304 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.516 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.21 151.53 49.15 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.539 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.84 94.7 5.08 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.078 -1.014 . . . . 0.0 108.97 -179.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.401 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 10.4 pt-20 -56.04 -23.69 34.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.23 -0.919 . . . . 0.0 110.762 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.506 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.9 mmtp -68.39 -9.57 49.21 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 178.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' A' ' 66' ' ' GLU . 16.5 mmtt -133.27 -12.14 2.8 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.983 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.539 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.65 46.65 26.32 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.8 t -115.06 -170.73 1.81 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.313 0.578 . . . . 0.0 109.774 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.532 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.55 97.42 4.54 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.525 -1.657 . . . . 0.0 106.525 177.212 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 11.1 mt -60.85 85.32 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.901 -1.124 . . . . 0.0 110.05 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -119.97 10.27 11.46 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.482 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -91.54 68.52 5.7 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.427 -0.796 . . . . 0.0 109.398 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.417 ' O ' ' O ' ' B' ' 605' ' ' CYS . 3.7 m -60.24 -5.51 1.13 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.995 -1.065 . . . . 0.0 108.968 179.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.482 ' H ' ' C ' ' A' ' 74' ' ' LYS . 40.1 m80 -59.27 -61.75 2.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.836 . . . . 0.0 112.099 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -88.07 -159.01 0.5 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.689 -1.257 . . . . 0.0 110.852 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.6 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -139.23 165.27 27.62 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.92 -1.113 . . . . 0.0 110.24 -178.208 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 11.1 mp -38.95 -65.4 0.37 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.076 0.941 . . . . 0.0 109.721 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -44.49 -52.29 8.04 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.852 0.834 . . . . 0.0 110.259 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.6 ' CG ' ' H ' ' A' ' 78' ' ' THR . 40.9 mmtt -45.25 -54.65 6.76 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.46 0.648 . . . . 0.0 109.722 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.86 -43.85 57.34 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.098 -1.041 . . . . 0.0 108.908 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 119.13 11.64 7.4 Favored Glycine 0 N--CA 1.5 2.913 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.55 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 33.7 mt -61.21 161.19 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.574 -0.957 . . . . 0.0 108.866 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -161.99 -169.15 2.11 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.297 -0.877 . . . . 0.0 109.239 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.91 -19.97 63.38 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.614 -0.679 . . . . 0.0 109.562 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.3 p30 -80.47 -8.26 59.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.289 -0.882 . . . . 0.0 109.184 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.524 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -93.07 113.35 25.59 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -93.28 115.88 28.46 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.767 -1.208 . . . . 0.0 109.551 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.9 mt -97.55 176.99 5.65 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.698 0.761 . . . . 0.0 109.507 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.516 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -132.81 168.59 18.11 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.194 -1.409 . . . . 0.0 107.194 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -133.31 99.35 4.5 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.5 162.32 42.63 Favored Pre-proline 0 N--CA 1.504 2.23 0 C-N-CA 120.214 -0.595 . . . . 0.0 111.642 -176.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_endo . . . . . 0 N--CA 1.499 1.85 0 C-N-CA 123.094 2.53 . . . . 0.0 111.763 178.529 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.306 0.574 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . 0.617 ' HD1' ' H ' ' B' ' 542' ' ' HIS . 2.9 m80 -61.59 -168.11 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.282 -0.886 . . . . 0.0 109.635 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -141.92 -0.02 1.36 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.333 -0.854 . . . . 0.0 109.695 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.7 103.67 14.71 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.072 -1.017 . . . . 0.0 109.561 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -161.67 0.41 Allowed 'General case' 0 C--N 1.307 -1.28 0 O-C-N 121.144 -0.973 . . . . 0.0 108.985 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -166.69 -101.49 0.15 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m -168.41 119.09 0.78 Allowed 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -59.03 135.04 57.5 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.783 -1.198 . . . . 0.0 110.211 -178.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.62 103.73 13.17 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.6 t -48.82 125.1 9.6 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-O 122.035 0.921 . . . . 0.0 109.639 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.5 -34.62 5.38 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 106.479 -2.648 . . . . 0.0 106.479 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.3 m -105.31 -35.26 7.6 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.417 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.3 mm-40 54.55 56.42 6.84 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.824 1.297 . . . . 0.0 109.881 -178.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -140.71 123.62 9.92 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -44.24 134.09 8.94 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 CA-C-N 120.574 1.241 . . . . 0.0 114.433 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.3 mt -91.74 98.31 8.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.429 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.5 p -99.46 91.01 4.72 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.286 -0.884 . . . . 0.0 111.159 -177.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.74 -96.2 0.15 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.462 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.6 mmt-85 -113.88 150.58 33.44 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 177.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 26.5 p -144.46 126.66 15.67 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.951 -1.093 . . . . 0.0 111.76 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 40.9 mt -91.32 146.68 5.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 12.2 m -120.72 146.53 46.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 121.81 0.814 . . . . 0.0 108.897 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.763 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.7 -129.02 0.26 Allowed 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.5 mtp -65.79 25.89 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.559 -0.713 . . . . 0.0 109.147 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.763 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.11 -8.51 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 -178.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.25 148.7 28.24 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -95.94 174.65 6.83 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.49 137.57 8.04 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.142 -1.423 . . . . 0.0 110.121 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.612 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.0 m80 -57.9 117.05 16.65 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.514 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.4 Cg_exo -44.11 -8.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.302 0 CA-C-N 120.114 1.076 . . . . 0.0 112.758 -178.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.612 ' N ' ' O ' ' B' ' 569' ' ' HIS . 8.2 mt-10 -106.41 -53.16 2.67 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 122.149 0.976 . . . . 0.0 109.623 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -55.5 -5.0 0.11 Allowed 'General case' 0 C--N 1.292 -1.927 0 O-C-N 120.312 -1.493 . . . . 0.0 109.495 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.54 ' H ' ' C ' ' B' ' 571' ' ' GLU . 39.8 t80 -125.44 52.96 1.58 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 11.6 m -92.93 177.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.453 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -80.39 141.85 34.95 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.53 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.4 75.6 3.89 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 116.842 -1.943 . . . . 0.0 109.915 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -153.33 -54.12 0.11 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 102.459 -3.163 . . . . 0.0 102.459 173.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.521 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.7 p -126.75 77.75 1.74 Allowed 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 111.68 -2.509 . . . . 0.0 104.396 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.3 mp -53.04 16.85 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.521 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.1 -37.71 21.67 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 119.545 -1.972 . . . . 0.0 112.233 -178.718 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -161.54 143.89 11.92 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 119.54 -1.975 . . . . 0.0 113.843 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.453 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.5 tp -136.62 170.59 15.82 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' B' ' 587' ' ' PHE . 70.3 m-20 -149.61 131.79 15.44 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.182 -0.949 . . . . 0.0 109.455 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -51.11 -19.16 1.03 Allowed 'General case' 0 C--N 1.302 -1.494 0 CA-C-O 121.564 0.697 . . . . 0.0 109.813 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.0 -20.54 55.28 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -134.34 26.62 3.8 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.52 107.73 19.35 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 122.657 1.218 . . . . 0.0 110.389 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.97 166.25 10.56 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.428 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.1 tt0 -153.01 157.28 40.3 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.815 -1.178 . . . . 0.0 110.653 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.503 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.6 tp-100 -156.22 146.13 21.2 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.573 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 46.41 23.65 0.24 Allowed 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.041 -1.037 . . . . 0.0 109.643 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 81.55 -5.74 1.55 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.782 -0.574 . . . . 0.0 110.8 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -88.34 116.25 65.67 Favored Pre-proline 0 C--N 1.294 -1.806 0 O-C-N 121.206 -0.934 . . . . 0.0 109.54 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.515 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 42.6 Cg_exo -49.51 164.2 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 CA-C-N 119.908 1.003 . . . . 0.0 112.141 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.515 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.77 140.03 1.6 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.179 -0.951 . . . . 0.0 110.163 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 11.0 m -73.51 152.88 40.53 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 174.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.437 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -55.69 -57.46 11.9 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -45.35 -29.44 1.05 Allowed 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.58 -0.7 . . . . 0.0 109.316 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 76.2 m -84.62 -66.17 0.92 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.611 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -43.86 -56.5 3.84 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.656 0.741 . . . . 0.0 109.577 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.611 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -51.73 -43.31 62.83 Favored 'General case' 0 C--N 1.293 -1.854 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -178.802 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -64.69 -20.48 66.34 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.705 -1.247 . . . . 0.0 110.807 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -90.17 -56.46 3.21 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.3 -1.5 . . . . 0.0 112.067 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.29 30.73 4.37 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.223 -0.923 . . . . 0.0 112.381 -176.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.417 ' O ' ' O ' ' A' ' 75' ' ' THR . 2.4 t . . . . . 0 N--CA 1.5 2.058 0 O-C-N 120.604 -1.31 . . . . 0.0 108.805 178.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.297 0.57 . . . . 0.0 109.595 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.89 -47.47 0.13 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.27 -0.894 . . . . 0.0 108.756 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.594 ' C ' ' H ' ' A' ' 5' ' ' GLY . 57.0 mt -45.68 -76.37 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.994 0.902 . . . . 0.0 109.369 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.7 t0 61.38 -7.09 0.1 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.942 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.594 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 116.75 -11.89 15.44 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 108.478 -1.849 . . . . 0.0 108.478 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.488 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -116.2 -109.46 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.023 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.541 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -159.47 -95.09 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.255 0 O-C-N 120.313 -1.492 . . . . 0.0 110.394 -179.297 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.541 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -130.46 -53.85 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.556 0 O-C-N 120.951 -1.093 . . . . 0.0 111.661 -179.16 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -56.11 -28.73 71.56 Favored 'Trans proline' 0 N--CA 1.497 1.703 0 CA-C-N 121.074 1.419 . . . . 0.0 110.345 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -119.61 -27.5 5.49 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.33 1.5 88.62 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.529 ' C ' ' H ' ' A' ' 14' ' ' ALA . 13.1 t -157.92 -35.57 0.07 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.281 -1.129 . . . . 0.0 109.416 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.496 ' CG ' ' NH1' ' A' ' 34' ' ' ARG . 1.7 t80 77.97 -33.16 0.17 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.529 ' H ' ' C ' ' A' ' 12' ' ' CYS . . . 169.92 -42.2 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.473 ' N ' ' SG ' ' A' ' 12' ' ' CYS . 29.8 t70 -159.21 9.13 0.12 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.216 -0.928 . . . . 0.0 110.281 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.531 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 100.41 38.48 3.49 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 108.443 -1.863 . . . . 0.0 108.443 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.92 122.4 23.37 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.568 -0.96 . . . . 0.0 109.532 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.531 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -133.01 124.55 27.9 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.535 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.12 128.71 34.21 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.819 -1.176 . . . . 0.0 109.134 -179.798 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.477 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -84.01 133.35 34.68 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.573 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.55 145.5 34.8 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.396 -0.815 . . . . 0.0 110.019 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.8 t -135.2 100.42 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.762 0.792 . . . . 0.0 109.066 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.534 ' CE1' ' OD1' ' A' ' 30' ' ' ASP . 7.7 m-70 -77.94 104.06 8.26 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 28' ' ' ASN . 4.8 t -74.75 117.88 19.62 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.128 -1.429 . . . . 0.0 108.965 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.27 -23.6 28.11 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.371 -0.831 . . . . 0.0 109.72 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.481 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -79.92 -8.86 59.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.0 108.373 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.404 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.0 mt -129.0 -23.62 3.02 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.523 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.22 12.11 2.78 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 -179.42 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -94.92 -177.96 4.34 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.197 -0.939 . . . . 0.0 109.445 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.534 ' OD1' ' CE1' ' A' ' 23' ' ' HIS . 2.1 m-20 -136.7 113.19 10.06 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.4 t -107.76 157.48 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.2 139.79 47.19 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.41 ' CD1' ' NZ ' ' A' ' 51' ' ' LYS . 2.3 mm? -120.16 112.55 19.23 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.663 -0.648 . . . . 0.0 109.56 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.496 ' NH1' ' CG ' ' A' ' 13' ' ' TYR . 15.7 tpt180 -61.47 107.01 0.72 Allowed 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -135.33 -168.94 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 CA-C-O 121.842 0.83 . . . . 0.0 110.339 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.409 ' H ' HG13 ' A' ' 39' ' ' VAL . 1.6 p -141.84 173.35 11.59 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.17 44.52 2.65 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.2 OUTLIER -144.67 2.95 1.09 Allowed 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.615 -0.932 . . . . 0.0 108.843 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.409 HG13 ' H ' ' A' ' 36' ' ' THR . 2.9 m -89.08 135.21 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 O-C-N 121.146 -0.971 . . . . 0.0 110.259 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.498 ' O ' ' N ' ' A' ' 43' ' ' GLY . 9.4 m-70 -78.4 148.2 33.75 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.921 -1.112 . . . . 0.0 108.866 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.474 ' C ' ' H ' ' A' ' 43' ' ' GLY . 38.7 mt -47.36 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.131 -0.981 . . . . 0.0 109.251 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.56 -13.36 2.87 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 108.625 -1.79 . . . . 0.0 108.625 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -82.23 -26.94 46.28 Favored Glycine 0 N--CA 1.483 1.833 0 N-CA-C 109.261 -1.536 . . . . 0.0 109.261 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.7 t -80.79 -55.26 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -1.105 . . . . 0.0 109.543 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.56 -40.58 38.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.766 -1.209 . . . . 0.0 108.996 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.8 tt -54.47 -58.88 5.73 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.079 -1.013 . . . . 0.0 109.35 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -59.39 -57.84 11.22 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.246 -0.909 . . . . 0.0 110.919 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.5 tp -44.81 -41.73 7.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.366 -0.834 . . . . 0.0 110.182 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.523 ' O ' ' N ' ' A' ' 53' ' ' ASP . 93.2 t -74.67 -43.49 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.821 -1.174 . . . . 0.0 109.52 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -45.79 -38.87 7.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.257 -0.902 . . . . 0.0 108.933 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.41 ' NZ ' ' CD1' ' A' ' 33' ' ' LEU . 54.5 mttp -67.44 -57.38 6.66 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.479 -0.763 . . . . 0.0 109.294 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.568 ' C ' ' H ' ' A' ' 54' ' ' VAL . 3.8 mm? -67.78 -66.22 0.59 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.523 ' N ' ' O ' ' A' ' 49' ' ' VAL . 2.8 t70 78.0 -34.02 0.18 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.875 0.845 . . . . 0.0 109.627 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.568 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.4 p -20.15 134.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.169 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.481 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.453 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.3 tttt -69.9 36.42 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.133 -0.98 . . . . 0.0 110.457 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.533 ' H ' ' C ' ' A' ' 54' ' ' VAL . 3.2 ttpm? -83.97 169.21 15.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.919 . . . . 0.0 108.531 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.535 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -79.71 123.54 27.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.021 -1.049 . . . . 0.0 109.545 -179.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.651 ' CZ3' ' CZ ' ' A' ' 92' ' ' PHE . 93.3 m95 -119.09 -48.54 2.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.453 -0.779 . . . . 0.0 109.934 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 p -45.51 -55.97 5.61 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.15 -0.968 . . . . 0.0 109.913 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -55.17 -32.17 61.95 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.535 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 8.8 m-70 -83.55 168.74 16.13 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.981 0.896 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.58 178.57 4.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.587 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -94.24 148.59 22.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.87 -1.144 . . . . 0.0 108.863 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.514 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.35 151.32 48.92 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.54 94.01 4.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.626 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -55.12 -24.2 24.86 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.316 -0.865 . . . . 0.0 111.028 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.511 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.4 mmtp -68.43 -8.81 43.99 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -133.76 -12.89 2.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.783 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 52.68 45.83 27.89 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -178.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -111.86 -173.61 2.28 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.311 0.577 . . . . 0.0 109.732 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.51 5.66 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 177.551 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 35.2 mt -59.81 82.6 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.047 0 O-C-N 120.661 -1.274 . . . . 0.0 110.745 -176.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.553 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -115.38 4.62 14.4 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.539 ' NZ ' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -80.59 72.08 7.49 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' HIS . 46.5 m -44.74 -53.09 7.72 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.204 -0.935 . . . . 0.0 109.742 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.425 ' O ' ' O ' ' A' ' 75' ' ' THR . 45.5 m-70 -51.9 -179.31 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.362 -0.836 . . . . 0.0 109.134 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 23.3 m0 55.92 173.65 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.741 0.781 . . . . 0.0 109.124 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.643 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -131.2 -164.6 1.46 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.681 0.753 . . . . 0.0 109.24 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.541 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.1 mp -70.68 -58.4 3.69 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -43.77 -52.4 6.64 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.67 0.748 . . . . 0.0 109.702 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.643 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.0 mmtt -46.11 -54.43 8.59 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.628 0.727 . . . . 0.0 109.558 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.539 ' OH ' ' NZ ' ' A' ' 74' ' ' LYS . 2.2 m-85 -72.59 -42.05 64.98 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.143 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.19 6.1 14.07 Favored Glycine 0 N--CA 1.5 2.966 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.514 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 52.0 mt -61.63 161.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.765 -0.844 . . . . 0.0 109.784 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -172.05 -162.91 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.19 70.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.368 -0.832 . . . . 0.0 109.956 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.416 ' OD2' ' O ' ' A' ' 87' ' ' ASP . 1.0 OUTLIER -68.42 -13.19 62.12 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -96.81 112.56 24.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -96.23 116.21 28.64 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.928 -1.107 . . . . 0.0 109.594 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.8 mt -91.99 175.73 6.76 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.514 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.7 mt-30 -134.68 160.34 38.44 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.651 ' CZ ' ' CZ3' ' A' ' 58' ' ' TRP . 0.1 OUTLIER -119.16 96.45 5.23 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -136.96 163.35 50.04 Favored Pre-proline 0 N--CA 1.503 2.197 0 O-C-N 121.858 -0.526 . . . . 0.0 110.266 -177.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.493 1.46 0 C-N-CA 122.927 2.418 . . . . 0.0 111.945 179.246 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -76.86 -75.43 0.2 Allowed 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.219 -0.926 . . . . 0.0 109.83 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.416 ' O ' ' O ' ' B' ' 544' ' ' ARG . 2.3 pt-20 -163.83 16.66 0.06 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.293 -0.879 . . . . 0.0 109.628 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.442 ' N ' ' CD ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER 51.17 94.57 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.288 -0.883 . . . . 0.0 108.931 -179.473 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.532 ' CD ' ' H ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -44.56 -45.33 9.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.753 -0.592 . . . . 0.0 110.531 -178.858 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -78.5 -135.6 0.99 Allowed Glycine 0 N--CA 1.487 2.072 0 C-N-CA 119.432 -1.366 . . . . 0.0 110.606 -178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.604 ' H ' ' H ' ' B' ' 556' ' ' ILE . 1.7 m -165.99 119.95 1.16 Allowed 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.6 mp -58.45 133.81 56.1 Favored 'General case' 0 C--N 1.293 -1.85 0 O-C-N 120.696 -1.253 . . . . 0.0 110.74 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 104.08 13.44 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 178.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.1 t -50.84 126.66 16.51 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 122.23 1.014 . . . . 0.0 109.728 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.37 5.5 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 106.216 -2.753 . . . . 0.0 106.216 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.7 m -105.72 -36.15 7.15 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.421 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.8 mm-40 55.65 56.2 6.42 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 122.719 1.247 . . . . 0.0 110.015 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -140.63 123.92 10.15 Favored Pre-proline 0 N--CA 1.497 1.88 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -44.07 133.94 8.52 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 CA-C-N 120.536 1.227 . . . . 0.0 114.488 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.604 ' H ' ' H ' ' B' ' 547' ' ' SER . 36.9 mt -91.85 98.53 8.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.77 92.13 5.17 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.203 -0.936 . . . . 0.0 111.338 -178.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.27 -95.24 0.15 Allowed Glycine 0 N--CA 1.488 2.118 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 10.0 mmt180 -114.2 151.13 33.23 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.1 p -144.45 126.25 15.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.944 -1.097 . . . . 0.0 111.676 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 41.0 mt -91.43 146.77 5.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.618 ' N ' ' HZ2' ' B' ' 584' ' ' LYS . 8.6 m -117.61 146.6 43.53 Favored 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.762 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.2 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.61 0.719 . . . . 0.0 109.389 -178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.549 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.9 mtp -65.96 26.44 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.762 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.12 -8.96 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 -178.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -82.14 161.92 22.65 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -103.77 174.66 5.77 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -161.09 135.07 6.89 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 118.03 -1.468 . . . . 0.0 110.089 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.586 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.8 m80 -55.53 116.0 10.79 Favored Pre-proline 0 C--N 1.301 -1.533 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.53 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 41.8 Cg_exo -46.46 -9.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.384 0 CA-C-N 120.27 1.132 . . . . 0.0 111.642 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.586 ' N ' ' O ' ' B' ' 569' ' ' HIS . 10.4 mt-10 -99.75 -52.41 3.46 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.418 1.104 . . . . 0.0 109.738 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 17.6 m170 -59.06 -3.2 0.33 Allowed 'General case' 0 C--N 1.289 -2.028 0 O-C-N 120.41 -1.432 . . . . 0.0 109.618 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.527 ' H ' ' C ' ' B' ' 571' ' ' GLU . 23.2 t80 -132.38 58.86 1.74 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . 0.409 HG11 ' O ' ' B' ' 571' ' ' GLU . 7.7 m -93.91 177.98 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.659 0.742 . . . . 0.0 110.777 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.484 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -75.52 145.64 41.17 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.95 75.7 3.11 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 116.661 -2.015 . . . . 0.0 109.935 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.1 -61.61 0.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 102.264 -3.236 . . . . 0.0 102.264 173.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.542 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.3 p -118.41 82.78 1.9 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 111.881 -2.418 . . . . 0.0 105.069 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mp -52.66 16.36 0.0 OUTLIER 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.75 -36.82 21.5 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 119.573 -1.954 . . . . 0.0 112.78 -178.153 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.53 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.2 tp60 -161.9 142.13 10.33 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 119.262 -2.149 . . . . 0.0 114.941 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.484 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 19.5 tp -140.38 167.63 21.7 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.526 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.7 m-20 -150.8 134.78 16.73 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.236 -0.915 . . . . 0.0 109.235 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.618 ' HZ2' ' N ' ' B' ' 562' ' ' THR . 1.8 ptpp? -52.58 -18.65 1.84 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.229 -0.919 . . . . 0.0 109.292 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.46 -18.19 57.43 Favored Glycine 0 N--CA 1.485 1.938 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 586' ' ' THR . . . . . 0.4 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.4 p -135.68 25.17 3.4 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.906 -0.761 . . . . 0.0 108.989 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.554 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -91.08 109.08 20.32 Favored 'General case' 0 N--CA 1.501 2.078 0 CA-C-O 122.564 1.173 . . . . 0.0 110.029 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -105.7 169.91 8.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 107.516 -1.291 . . . . 0.0 107.516 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.425 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.2 tt0 -152.62 157.19 40.63 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.737 -1.227 . . . . 0.0 110.616 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.503 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -157.1 146.52 20.35 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.606 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 47.89 22.93 0.41 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.923 -1.11 . . . . 0.0 109.59 -179.323 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.473 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 81.81 -7.03 1.43 Allowed 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.789 -0.57 . . . . 0.0 111.234 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . 0.402 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 38.3 mttm -89.59 121.07 69.5 Favored Pre-proline 0 C--N 1.297 -1.711 0 O-C-N 121.033 -1.042 . . . . 0.0 109.711 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.537 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.5 Cg_exo -49.61 164.18 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.235 0 CA-C-N 120.174 1.098 . . . . 0.0 111.656 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.537 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.6 m-85 -170.28 139.95 1.81 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.242 -0.911 . . . . 0.0 109.873 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 3.8 m -69.69 154.08 42.49 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 175.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.422 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.09 -57.59 12.39 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 178.357 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.8 -29.68 1.41 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 4.6 m -82.43 -67.55 0.78 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.639 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.32 -59.16 3.1 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.523 0.678 . . . . 0.0 110.224 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.639 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -50.44 -42.7 54.53 Favored 'General case' 0 C--N 1.293 -1.851 0 O-C-N 121.539 -0.725 . . . . 0.0 109.429 -178.567 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 8.7 tptp -62.78 -22.84 66.89 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.089 -1.007 . . . . 0.0 111.199 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.92 -44.69 8.32 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.325 -1.484 . . . . 0.0 110.26 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.447 ' O ' ' C ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -120.06 32.85 5.85 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.528 -0.733 . . . . 0.0 109.831 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.447 ' C ' ' O ' ' B' ' 604' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.503 2.2 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.624 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.624 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -143.37 -55.09 0.39 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.116 -0.99 . . . . 0.0 108.607 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.5 mt -43.9 -80.43 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.294 1.045 . . . . 0.0 109.435 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.442 ' C ' ' H ' ' A' ' 6' ' ' ILE . 17.0 t70 52.86 14.45 0.44 Allowed 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.836 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.49 -12.95 35.34 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 106.727 -2.549 . . . . 0.0 106.727 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.504 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -112.5 -107.54 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -179.834 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.437 ' HB3' ' H ' ' A' ' 8' ' ' MET . 4.4 tpp180 -172.31 -90.13 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.16 0 O-C-N 120.846 -1.159 . . . . 0.0 111.494 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.555 ' O ' ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -120.33 -54.04 0.04 OUTLIER Pre-proline 0 N--CA 1.501 2.088 0 O-C-N 121.844 -0.535 . . . . 0.0 112.215 -176.351 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -58.67 -40.28 74.76 Favored 'Trans proline' 0 N--CA 1.5 1.861 0 C-N-CA 121.686 1.591 . . . . 0.0 111.496 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -112.71 -23.25 10.29 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.62 -4.55 90.19 Favored Glycine 0 N--CA 1.484 1.852 0 N-CA-C 108.271 -1.932 . . . . 0.0 108.271 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 9.0 t -173.66 -85.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.503 -0.998 . . . . 0.0 109.744 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.555 ' N ' ' O ' ' A' ' 8' ' ' MET . 11.6 t80 -176.57 -65.79 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -172.54 -48.95 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -146.2 2.9 0.89 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.432 -0.792 . . . . 0.0 109.431 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.03 16.4 41.42 Favored Glycine 0 N--CA 1.494 2.502 0 N-CA-C 108.542 -1.823 . . . . 0.0 108.542 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.5 p -93.92 122.07 36.04 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.551 -0.97 . . . . 0.0 109.475 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.404 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -125.78 123.51 38.94 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.535 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.23 129.99 34.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 108.807 -179.806 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.446 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.34 131.46 35.06 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.66 34.68 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.287 -0.883 . . . . 0.0 110.098 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 33.1 t -136.39 106.96 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 CA-C-O 121.67 0.747 . . . . 0.0 109.21 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.502 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 5.9 m170 -77.81 103.43 7.75 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 178.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.1 t -69.35 107.38 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.621 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' LEU . 11.5 p -74.27 -65.31 0.86 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.542 -0.724 . . . . 0.0 111.122 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' OG1' ' A' ' 25' ' ' THR . 19.3 t0 -46.9 -13.15 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.088 -1.007 . . . . 0.0 110.027 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.549 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.5 mm? -112.12 -48.03 3.07 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.424 -0.797 . . . . 0.0 109.062 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER 98.02 13.06 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -177.531 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.1 mtp-105 -94.77 -176.85 4.0 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.125 0.965 . . . . 0.0 109.702 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.502 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 2.4 m-20 -138.34 116.02 11.41 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.6 t -113.15 155.96 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-O 121.532 0.682 . . . . 0.0 109.341 -179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.56 133.92 40.79 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -113.85 113.16 24.51 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -60.26 107.58 0.67 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.4 m -134.5 -169.77 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.822 0.82 . . . . 0.0 110.114 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.9 p -142.61 173.25 11.7 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.404 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -78.89 46.61 2.95 Favored Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -148.57 4.89 0.69 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.675 -0.897 . . . . 0.0 108.982 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.3 m -90.49 144.31 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.01 -1.057 . . . . 0.0 110.174 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.492 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 p-80 -84.47 146.45 27.6 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.924 -1.11 . . . . 0.0 108.797 178.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 68.3 mt -48.93 -53.68 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 120.937 -1.102 . . . . 0.0 108.683 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.72 -15.32 4.49 Favored Glycine 0 N--CA 1.485 1.945 0 N-CA-C 108.148 -1.981 . . . . 0.0 108.148 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -76.85 -30.62 55.67 Favored Glycine 0 N--CA 1.483 1.777 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -83.71 -43.47 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.61 -0.935 . . . . 0.0 108.62 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.58 -37.67 12.87 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.112 -0.992 . . . . 0.0 108.389 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -70.21 -61.06 1.92 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.657 -0.652 . . . . 0.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -53.89 -59.22 4.91 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.178 -0.952 . . . . 0.0 111.663 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.18 -44.3 10.76 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.072 -1.017 . . . . 0.0 110.088 -177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 52' ' ' LEU . 24.6 t -70.89 -46.76 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.138 -0.976 . . . . 0.0 109.418 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -44.7 -37.75 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.31 -0.869 . . . . 0.0 109.646 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.487 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 7.8 mtmp? -71.46 -33.8 69.65 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.446 -0.784 . . . . 0.0 109.585 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.1 tp -64.01 -67.9 0.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 t70 67.03 78.76 0.24 Allowed 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.807 0.813 . . . . 0.0 110.572 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.597 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -171.9 149.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.623 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.46 33.97 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.264 -0.897 . . . . 0.0 109.028 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.597 ' H ' ' C ' ' A' ' 54' ' ' VAL . 43.3 tttp -78.07 164.55 24.93 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.313 -0.867 . . . . 0.0 109.146 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.14 91.57 4.34 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.358 -0.838 . . . . 0.0 109.154 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -72.35 -52.05 17.87 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.585 ' C ' ' H ' ' A' ' 61' ' ' HIS . 76.1 p -47.82 -41.84 24.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.62 -0.675 . . . . 0.0 110.008 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -53.99 -4.83 0.06 Allowed 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.25 -0.907 . . . . 0.0 109.091 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.596 ' CG ' ' CE2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -119.12 161.62 20.0 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-O 122.008 0.909 . . . . 0.0 110.129 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . . . -169.99 165.56 9.45 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.494 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -93.35 132.88 37.16 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.603 -1.311 . . . . 0.0 109.637 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -119.73 147.85 44.1 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.618 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -108.29 93.0 4.29 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.112 -0.992 . . . . 0.0 108.551 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.402 ' C ' ' H ' ' A' ' 68' ' ' LYS . 18.2 pt-20 -54.95 -24.12 22.35 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.243 -0.911 . . . . 0.0 110.895 -179.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.52 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 26.0 mmtt -68.58 -8.28 40.31 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 65' ' ' TRP . 16.9 mmtt -133.86 -12.75 2.56 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.9 OUTLIER 52.86 45.77 28.1 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -178.236 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.678 ' HG1' ' H ' ' A' ' 71' ' ' TRP . 5.3 t -113.02 -173.2 2.2 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.423 0.63 . . . . 0.0 109.914 -178.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.678 ' H ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -128.71 98.61 5.05 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 177.082 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.67 82.98 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 O-C-N 120.86 -1.15 . . . . 0.0 110.449 -176.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -117.79 6.84 12.35 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.656 ' HZ3' ' HH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -84.11 68.78 10.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.759 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.414 ' C ' ' O ' ' A' ' 74' ' ' LYS . 28.4 m -40.84 -38.5 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.542 -0.724 . . . . 0.0 110.073 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.541 ' HD1' ' H ' ' A' ' 76' ' ' HIS . 15.4 m80 -58.72 171.45 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.266 -0.896 . . . . 0.0 108.964 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 16.7 m0 56.51 168.17 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.61 0.719 . . . . 0.0 109.737 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.605 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -121.7 -164.48 1.15 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.693 0.758 . . . . 0.0 109.477 -178.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.54 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 4.8 mp -70.41 -59.44 2.86 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -42.82 -51.91 5.25 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.833 0.825 . . . . 0.0 109.755 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.605 ' CG ' ' H ' ' A' ' 78' ' ' THR . 23.0 mmtp -47.16 -54.68 10.05 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.742 0.782 . . . . 0.0 109.362 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.656 ' HH ' ' HZ3' ' A' ' 74' ' ' LYS . 18.5 m-85 -69.21 -43.37 74.26 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.345 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.77 4.23 17.24 Favored Glycine 0 N--CA 1.499 2.843 0 N-CA-C 108.176 -1.97 . . . . 0.0 108.176 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.535 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 45.4 mt -61.55 161.21 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.772 -0.84 . . . . 0.0 109.331 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.535 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -173.15 -166.29 0.34 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.463 -0.773 . . . . 0.0 109.134 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.38 -22.83 64.63 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.409 -0.807 . . . . 0.0 109.968 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -77.41 -11.37 59.83 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.03 113.03 25.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -97.08 118.09 32.72 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.095 -1.003 . . . . 0.0 109.541 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.9 mt -94.63 177.13 6.02 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 4.8 mt-30 -132.89 158.61 42.12 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.329 -1.359 . . . . 0.0 107.329 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.596 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -101.33 109.35 21.18 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 62' ' ' ALA . 0.4 OUTLIER -162.17 158.78 21.08 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 120.555 -1.34 . . . . 0.0 109.459 -177.67 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo . . . . . 0 N--CA 1.492 1.391 0 C-N-CA 122.471 2.114 . . . . 0.0 111.744 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -67.01 -109.97 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.141 -0.974 . . . . 0.0 110.051 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.44 -24.8 0.34 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.307 -0.871 . . . . 0.0 109.603 -179.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.35 118.33 22.56 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.179 -0.951 . . . . 0.0 109.007 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.48 ' N ' ' CD ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -132.64 -33.86 1.2 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.523 -0.736 . . . . 0.0 109.884 -178.705 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . 0.474 ' O ' ' O ' ' B' ' 545' ' ' ARG . . . -52.2 -110.98 0.01 OUTLIER Glycine 0 N--CA 1.496 2.655 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.534 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m -165.7 118.52 1.13 Allowed 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -59.96 135.57 57.75 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 120.938 -1.102 . . . . 0.0 110.431 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.58 103.93 13.3 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 178.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.3 t -51.28 127.08 18.58 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.245 1.021 . . . . 0.0 109.727 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.6 -34.79 5.27 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 106.206 -2.758 . . . . 0.0 106.206 -177.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.5 m -105.4 -35.93 7.34 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.416 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.9 mm-40 55.92 56.49 5.96 Favored 'General case' 0 C--N 1.3 -1.557 0 CA-C-O 122.694 1.235 . . . . 0.0 110.079 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp -140.47 123.6 10.14 Favored Pre-proline 0 N--CA 1.496 1.84 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -44.2 134.99 8.66 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.519 1.221 . . . . 0.0 114.743 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.1 mt -94.22 98.29 7.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -99.85 91.17 4.7 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.218 -0.926 . . . . 0.0 111.25 -177.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.77 -95.9 0.15 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 107.584 -2.206 . . . . 0.0 107.584 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.474 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 11.5 mmt180 -112.48 151.31 30.08 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 22.3 p -144.77 126.29 15.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.957 -1.089 . . . . 0.0 111.438 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.97 146.65 5.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.702 ' H ' ' HZ3' ' B' ' 584' ' ' LYS . 7.4 m -118.28 146.78 44.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-O 121.853 0.835 . . . . 0.0 109.158 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.729 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.69 -129.11 0.26 Allowed 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 121.601 0.715 . . . . 0.0 109.441 -178.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 8.4 mtp -65.75 26.07 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.729 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.14 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.95 162.67 22.61 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -104.87 174.56 5.82 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.24 134.0 7.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.417 -1.427 . . . . 0.0 110.24 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.6 m80 -54.04 114.09 5.98 Favored Pre-proline 0 C--N 1.303 -1.443 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 176.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.585 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 37.0 Cg_exo -46.85 -11.45 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.381 1.172 . . . . 0.0 111.218 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' B' ' 569' ' ' HIS . 7.7 mt-10 -95.43 -51.79 4.42 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.046 0.927 . . . . 0.0 110.185 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.471 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.1 m170 -60.21 -3.56 0.64 Allowed 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.982 -1.074 . . . . 0.0 109.859 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' B' ' 571' ' ' GLU . 24.2 t80 -130.31 57.95 1.69 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 17.1 m -94.32 178.04 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-O 121.74 0.781 . . . . 0.0 111.167 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.461 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.93 145.35 30.36 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.169 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -93.56 75.48 4.4 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.794 -1.962 . . . . 0.0 109.239 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -153.46 -64.74 0.15 Allowed 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 102.163 -3.273 . . . . 0.0 102.163 173.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.555 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -114.28 79.43 1.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 111.897 -2.411 . . . . 0.0 104.583 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 9.4 mt -52.86 16.0 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.84 -36.61 15.93 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 119.739 -1.851 . . . . 0.0 112.459 -178.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.585 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.1 tp60 -158.83 140.1 13.13 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 119.562 -1.961 . . . . 0.0 114.822 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.461 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.1 tp -137.94 169.51 17.66 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.435 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.2 m-20 -148.0 130.79 16.06 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.285 -0.884 . . . . 0.0 109.041 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.702 ' HZ3' ' H ' ' B' ' 562' ' ' THR . 0.6 OUTLIER -52.13 -17.2 0.99 Allowed 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.432 -0.793 . . . . 0.0 109.606 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.39 -20.6 51.54 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.24 27.59 4.13 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.85 108.78 19.91 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.589 1.185 . . . . 0.0 109.979 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.507 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.51 168.22 9.64 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.72 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.431 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.95 157.29 40.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.707 -1.246 . . . . 0.0 110.693 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.542 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 3.2 tp60 -155.25 145.96 22.28 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.532 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.0 23.66 0.09 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.09 -1.006 . . . . 0.0 109.97 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 83.43 -6.48 1.17 Allowed 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.828 -0.545 . . . . 0.0 110.869 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -88.0 118.68 69.92 Favored Pre-proline 0 C--N 1.294 -1.816 0 O-C-N 121.279 -0.888 . . . . 0.0 109.559 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.513 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 37.0 Cg_exo -49.41 165.58 0.24 Allowed 'Trans proline' 0 N--CA 1.489 1.209 0 CA-C-N 120.089 1.067 . . . . 0.0 111.808 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.513 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.9 m-85 -170.82 137.66 1.29 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.133 -0.979 . . . . 0.0 110.473 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 28.5 m -70.36 155.63 40.41 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 104.247 -2.501 . . . . 0.0 104.247 174.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.446 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.11 -57.55 12.55 Favored 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 117.563 -1.655 . . . . 0.0 107.001 179.479 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -29.77 1.42 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 89.9 m -80.04 -65.62 0.98 Allowed 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.288 -0.882 . . . . 0.0 108.791 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.578 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.68 -55.86 17.02 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.751 -0.593 . . . . 0.0 110.048 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.578 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -47.06 -39.08 12.22 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.296 -0.877 . . . . 0.0 108.792 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt -67.91 -20.38 65.08 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.57 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 9.6 mt -90.66 -56.84 3.04 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.542 -1.349 . . . . 0.0 111.937 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.542 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 6.2 m-85 -91.61 -29.24 17.02 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.672 -1.268 . . . . 0.0 110.351 -178.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.421 ' O ' ' O ' ' B' ' 601' ' ' LEU . 74.2 m . . . . . 0 N--CA 1.501 2.091 0 CA-C-O 118.062 -0.971 . . . . 0.0 109.448 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.5 ttm . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.3 -54.03 0.12 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.119 -0.988 . . . . 0.0 108.78 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.485 ' C ' ' N ' ' A' ' 5' ' ' GLY . 2.3 mp -45.77 -80.3 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.844 0.831 . . . . 0.0 110.426 179.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' CG ' ' O ' ' A' ' 4' ' ' ASP . 19.4 t70 49.6 18.1 0.28 Allowed 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -178.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.485 ' N ' ' C ' ' A' ' 3' ' ' LEU . . . -70.95 -8.46 64.37 Favored Glycine 0 N--CA 1.486 2.014 0 N-CA-C 108.443 -1.863 . . . . 0.0 108.443 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.483 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -114.74 -105.09 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -178.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.523 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -151.76 -96.38 0.06 Allowed 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.594 -1.316 . . . . 0.0 109.882 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.546 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -142.13 -61.78 0.02 OUTLIER Pre-proline 0 N--CA 1.501 2.108 0 O-C-N 121.026 -1.046 . . . . 0.0 110.468 -179.503 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -44.8 -29.63 3.71 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 CA-C-N 121.329 1.51 . . . . 0.0 109.786 178.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -119.59 -23.67 6.5 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.194 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.84 -1.37 76.91 Favored Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.546 ' N ' ' O ' ' A' ' 8' ' ' MET . 30.1 t -169.43 -7.85 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.154 -1.204 . . . . 0.0 111.248 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.513 ' N ' ' O ' ' A' ' 8' ' ' MET . 14.2 m-85 68.78 -80.01 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.222 -0.923 . . . . 0.0 108.885 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.481 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 166.21 -39.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.458 -0.776 . . . . 0.0 109.144 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -140.91 -0.57 1.48 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.462 -0.773 . . . . 0.0 109.577 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 88.52 31.86 12.64 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -85.46 122.83 30.16 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.435 -1.038 . . . . 0.0 109.274 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.417 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -131.79 123.15 27.02 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 179.258 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.14 129.82 35.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.982 . . . . 0.0 108.592 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.481 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.31 131.57 35.07 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -77.85 145.63 36.17 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.444 -0.903 . . . . 0.0 109.296 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.1 t -138.93 113.53 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-O 121.868 0.842 . . . . 0.0 109.909 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.508 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 7.6 m170 -85.83 103.5 14.64 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.525 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -72.44 99.3 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.568 ' C ' ' H ' ' A' ' 27' ' ' LEU . 59.2 p -73.67 -38.3 64.99 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.533 -0.729 . . . . 0.0 109.968 -178.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.41 18.16 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.061 -1.024 . . . . 0.0 108.627 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.568 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.9 mt -152.03 -30.53 0.16 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 84.7 13.61 0.24 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 122.248 -0.282 . . . . 0.0 110.351 -179.784 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -98.42 -178.2 3.94 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 120.954 -1.091 . . . . 0.0 109.952 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.508 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 32.1 m-20 -138.97 117.57 12.16 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 t -117.97 157.3 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-O 121.629 0.728 . . . . 0.0 110.096 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.79 135.33 43.79 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.406 ' CD1' ' NZ ' ' A' ' 51' ' ' LYS . 2.4 mm? -116.51 112.29 21.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.566 -0.709 . . . . 0.0 109.336 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -60.66 103.92 0.3 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 22.1 m -136.28 -170.64 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.972 0.891 . . . . 0.0 110.338 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.417 ' OG1' ' CG ' ' A' ' 38' ' ' GLU . 5.6 p -143.06 176.3 9.2 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.6 45.72 2.94 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.417 ' CG ' ' OG1' ' A' ' 36' ' ' THR . 3.2 pt-20 -144.97 -0.13 0.92 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.295 -1.121 . . . . 0.0 108.605 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.401 HG11 ' H ' ' A' ' 36' ' ' THR . 1.7 m -87.89 134.11 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 121.006 -1.059 . . . . 0.0 109.81 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 m-70 -69.61 139.41 53.62 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 121.1 -1.0 . . . . 0.0 108.823 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.469 ' C ' ' H ' ' A' ' 43' ' ' GLY . 14.7 mt -47.31 -58.55 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.0 109.322 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.51 -13.19 5.38 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 108.219 -1.952 . . . . 0.0 108.219 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.84 -24.95 73.02 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 6.4 t -83.67 -38.5 14.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.476 ' O ' ' CG2' ' A' ' 49' ' ' VAL . 31.6 mtm -48.41 -37.39 16.88 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.1 tp -73.57 -61.27 1.89 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.738 -0.602 . . . . 0.0 110.788 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -53.49 -61.27 2.41 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.214 -0.929 . . . . 0.0 110.889 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.6 tp -49.74 -35.06 20.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.277 -0.889 . . . . 0.0 109.416 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.476 ' CG2' ' O ' ' A' ' 45' ' ' MET . 9.2 t -73.02 -48.6 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.33 -0.856 . . . . 0.0 108.767 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -44.71 -37.44 3.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.536 -0.727 . . . . 0.0 109.559 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' NZ ' ' CD1' ' A' ' 33' ' ' LEU . 55.5 mttp -71.16 -34.75 71.27 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.449 -0.782 . . . . 0.0 110.355 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -63.24 1.33 Allowed 'General case' 0 C--N 1.306 -1.283 0 O-C-N 120.953 -1.092 . . . . 0.0 109.062 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 t70 69.54 78.3 0.21 Allowed 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.884 0.85 . . . . 0.0 109.895 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.586 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -171.51 147.42 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 C-N-CA 119.951 -0.699 . . . . 0.0 110.391 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -68.96 35.37 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.444 -0.785 . . . . 0.0 108.959 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.586 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.4 ttmm -78.34 154.64 30.65 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.12 -0.988 . . . . 0.0 108.817 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.22 97.75 0.75 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 108.767 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.541 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 45.7 m0 -80.45 -45.19 18.01 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.809 -0.557 . . . . 0.0 110.095 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.2 t -56.39 -56.61 19.03 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.995 -1.066 . . . . 0.0 110.399 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.426 ' OD1' ' O ' ' A' ' 94' ' ' PRO . 16.3 t70 -49.83 -24.63 2.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.16 -0.963 . . . . 0.0 108.881 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.541 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -73.36 148.17 43.66 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.961 0.886 . . . . 0.0 109.731 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -160.68 152.6 19.94 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.566 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -94.79 143.06 26.76 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.141 -0.975 . . . . 0.0 109.716 -179.088 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.531 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.23 137.4 52.88 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.5 t90 -95.77 89.78 5.42 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.589 -0.694 . . . . 0.0 109.425 -179.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.471 ' C ' ' N ' ' A' ' 68' ' ' LYS . 14.4 pt-20 -53.98 -23.78 14.39 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.176 -0.952 . . . . 0.0 110.298 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.477 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.5 mmtp -63.91 -10.8 22.95 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.471 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -134.95 -12.3 2.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.212 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.6 44.95 29.07 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -110.03 -174.15 2.42 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.515 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.92 99.6 5.58 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 177.529 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.6 mt -59.88 83.75 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.053 0 CA-C-O 122.361 1.077 . . . . 0.0 110.662 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.5 6.69 10.07 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.133 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.465 ' HZ1' ' HZ1' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.73 74.04 5.27 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.21 -0.931 . . . . 0.0 109.542 -179.472 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.416 ' C ' ' H ' ' A' ' 77' ' ' TRP . 11.8 p -75.93 -18.55 59.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.285 -0.884 . . . . 0.0 109.882 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -76.76 36.54 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.117 -0.989 . . . . 0.0 110.25 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.416 ' H ' ' C ' ' A' ' 75' ' ' THR . 0.0 OUTLIER -175.57 -143.81 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.484 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -152.96 149.53 28.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.851 -1.781 . . . . 0.0 109.506 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 82' ' ' TYR . 1.3 pt? -40.2 -48.63 2.59 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.196 -0.94 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.436 ' H ' HD21 ' A' ' 79' ' ' LEU . 18.0 t70 -47.23 -33.46 5.47 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.171 -0.956 . . . . 0.0 109.574 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.535 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.73 -31.08 70.77 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.535 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -79.02 -50.93 10.3 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 178.629 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.1 9.39 6.13 Favored Glycine 0 N--CA 1.509 3.562 0 N-CA-C 108.898 -1.681 . . . . 0.0 108.898 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.546 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 56.4 mt -60.63 161.35 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.546 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.47 -168.68 1.57 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.255 -0.903 . . . . 0.0 109.074 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.34 -23.04 65.58 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.284 -0.885 . . . . 0.0 110.157 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -2.24 56.99 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.196 -0.94 . . . . 0.0 108.908 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.481 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.37 113.03 25.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.527 -0.733 . . . . 0.0 109.641 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp -98.32 115.55 28.67 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.995 -1.066 . . . . 0.0 109.741 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.7 mt -95.38 176.11 6.32 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -133.58 156.63 47.48 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.538 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 2.2 t80 -115.21 126.4 54.51 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.19 159.06 26.71 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 120.992 -1.068 . . . . 0.0 110.274 -178.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . 0.426 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 9.6 Cg_endo . . . . . 0 N--CA 1.497 1.694 0 C-N-CA 122.789 2.326 . . . . 0.0 111.735 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . 0.449 ' O ' ' CD1' ' B' ' 541' ' ' TYR . 58.7 t80 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . 0.577 ' CD2' ' N ' ' B' ' 542' ' ' HIS . 2.4 m170 -63.86 -152.94 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.304 -0.872 . . . . 0.0 109.587 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.406 ' O ' ' C ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER -163.83 -80.99 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 109.295 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' B' ' 543' ' ' GLU . 10.5 mpt_? 38.84 32.02 0.05 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.726 -0.609 . . . . 0.0 110.616 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.486 ' HD2' ' H ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -52.84 -76.24 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.262 -0.899 . . . . 0.0 108.773 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -167.07 -99.08 0.13 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.536 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m -169.56 118.22 0.63 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -58.15 135.67 57.1 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.893 -1.129 . . . . 0.0 110.375 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -84.01 104.12 13.82 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 178.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.52 125.4 11.24 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 122.077 0.941 . . . . 0.0 109.695 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -33.86 5.83 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 106.569 -2.612 . . . . 0.0 106.569 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.1 m -106.3 -35.52 7.13 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.408 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 54.97 56.65 6.38 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.793 1.283 . . . . 0.0 109.937 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -140.66 123.77 10.04 Favored Pre-proline 0 C--N 1.295 -1.78 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -44.1 134.03 8.57 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 CA-C-N 120.461 1.2 . . . . 0.0 114.674 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.536 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.2 mt -92.65 98.37 8.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' B' ' 557' ' ' THR . 6.9 p -99.71 91.16 4.73 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.301 -177.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.1 -96.01 0.15 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.433 -2.267 . . . . 0.0 107.433 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -113.2 150.9 31.66 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.53 126.48 15.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.0 -1.062 . . . . 0.0 111.384 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.3 mt -90.57 146.21 6.47 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.3 m -121.21 146.4 46.84 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-O 121.982 0.896 . . . . 0.0 108.968 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.713 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -124.56 -127.9 0.25 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-O 122.092 0.949 . . . . 0.0 108.783 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 0.0 OUTLIER -65.51 28.1 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.713 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 103.43 -8.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 149.64 26.75 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -95.69 174.86 6.77 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -160.36 134.02 6.99 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 118.289 -1.365 . . . . 0.0 110.077 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.59 ' O ' ' N ' ' B' ' 571' ' ' GLU . 6.0 m80 -55.65 115.84 10.49 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 177.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 53.0 Cg_exo -45.32 -9.5 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.43 0 CA-C-N 120.298 1.142 . . . . 0.0 112.141 -178.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.59 ' N ' ' O ' ' B' ' 569' ' ' HIS . 7.3 mt-10 -102.03 -52.55 3.14 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 122.059 0.933 . . . . 0.0 109.978 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.452 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 16.7 m170 -56.88 -3.96 0.14 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.862 -1.149 . . . . 0.0 109.992 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.52 ' H ' ' C ' ' B' ' 571' ' ' GLU . 20.6 t80 -126.6 55.6 1.52 Allowed 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . 0.419 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 16.1 m -94.25 177.68 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-O 121.711 0.767 . . . . 0.0 110.818 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.465 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.62 145.06 33.27 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.45 74.21 3.28 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 116.621 -2.031 . . . . 0.0 109.03 178.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.34 -47.45 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 102.87 -3.011 . . . . 0.0 102.87 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.572 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.6 p -132.95 81.28 1.93 Allowed 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.282 -2.236 . . . . 0.0 104.975 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . 0.63 ' CD1' ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.67 15.5 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -176.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.09 -36.95 17.83 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 119.474 -2.016 . . . . 0.0 112.69 -178.302 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -160.36 140.1 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 119.416 -2.052 . . . . 0.0 114.969 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.465 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.6 tp -139.53 169.3 18.0 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.455 ' O ' ' N ' ' B' ' 587' ' ' PHE . 71.8 m-20 -145.62 130.55 18.23 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.159 -0.963 . . . . 0.0 108.864 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -52.44 -21.38 3.62 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.433 -0.792 . . . . 0.0 109.577 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.2 -16.35 60.94 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.6 p -134.66 26.27 3.7 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.906 -0.761 . . . . 0.0 108.971 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -88.64 109.69 20.32 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 122.443 1.116 . . . . 0.0 109.484 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.46 162.55 12.96 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.2 tt0 -153.83 156.89 38.48 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.558 1.17 . . . . 0.0 111.026 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.498 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 4.4 tt0 -156.46 141.52 17.25 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 105.985 -1.857 . . . . 0.0 105.985 178.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.706 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.95 25.81 3.32 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 120.846 -1.159 . . . . 0.0 109.288 178.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.8 m-20 79.85 -7.7 1.64 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.708 -0.62 . . . . 0.0 111.365 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . 0.458 ' O ' ' CE2' ' B' ' 595' ' ' TYR . 15.9 mttt -86.99 115.69 63.47 Favored Pre-proline 0 C--N 1.295 -1.791 0 O-C-N 121.153 -0.967 . . . . 0.0 110.282 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.597 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 32.7 Cg_exo -53.31 160.53 4.7 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 CA-C-N 119.969 1.025 . . . . 0.0 111.979 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.597 ' CD1' ' O ' ' B' ' 594' ' ' PRO . 51.8 m-85 -168.19 135.59 2.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.623 -0.673 . . . . 0.0 110.167 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.7 m -65.53 154.97 37.12 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 175.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.451 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.73 -57.35 13.06 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 178.628 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.09 -29.18 1.41 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 17.8 m -81.81 -61.18 1.99 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.537 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -56.59 -52.26 65.51 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.207 0.527 . . . . 0.0 110.133 -179.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.537 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -50.95 -43.33 60.26 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.055 -1.028 . . . . 0.0 109.072 -178.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.59 -21.2 16.34 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.558 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 1.7 mt -94.24 -56.41 2.85 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.86 -1.15 . . . . 0.0 111.111 -178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.503 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 23.9 m-85 -94.91 5.5 51.73 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.934 -1.104 . . . . 0.0 110.11 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.503 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 20.0 m . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.958 -1.089 . . . . 0.0 109.41 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.8 ttt . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.53 ' O ' ' N ' ' A' ' 4' ' ' ASP . . . -160.72 -48.35 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.886 -1.134 . . . . 0.0 109.318 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.479 ' C ' ' O ' ' A' ' 2' ' ' ALA . 20.1 mt 23.6 -85.74 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.728 0.775 . . . . 0.0 112.056 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 2' ' ' ALA . 11.8 t0 51.56 18.56 0.71 Allowed 'General case' 0 C--N 1.3 -1.553 0 CA-C-O 122.253 1.025 . . . . 0.0 108.314 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.444 ' N ' ' C ' ' A' ' 3' ' ' LEU . . . -69.87 -7.98 60.05 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 108.375 -1.89 . . . . 0.0 108.375 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.92 -111.45 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.511 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -159.22 -94.14 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 O-C-N 120.335 -1.478 . . . . 0.0 110.398 -179.848 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.578 ' O ' ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -131.35 -54.86 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.547 0 O-C-N 121.022 -1.049 . . . . 0.0 111.786 -178.86 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -48.95 -19.62 2.42 Favored 'Trans proline' 0 N--CA 1.489 1.238 0 CA-C-N 120.916 1.363 . . . . 0.0 109.486 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.435 ' N ' ' C ' ' A' ' 8' ' ' MET . 10.1 t70 -142.21 -18.14 0.72 Allowed 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.882 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.99 -14.32 49.55 Favored Glycine 0 N--CA 1.493 2.45 0 O-C-N 121.025 -1.047 . . . . 0.0 111.299 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.539 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 2.8 t -173.94 -34.08 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.612 -1.522 . . . . 0.0 111.266 -179.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.578 ' N ' ' O ' ' A' ' 8' ' ' MET . 4.7 t80 86.38 -43.53 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.495 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 160.45 -47.96 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -153.38 7.1 0.37 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.96 14.09 75.97 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.9 p -91.09 122.84 34.07 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.714 -0.874 . . . . 0.0 109.987 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -129.66 121.49 27.09 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.84 128.93 35.51 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.247 -0.908 . . . . 0.0 108.875 -179.664 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.491 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.67 132.3 34.89 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.411 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.56 145.71 34.67 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.726 -0.79 . . . . 0.0 110.22 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.9 t -135.4 103.97 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 CA-C-O 121.586 0.707 . . . . 0.0 109.49 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -78.05 104.48 8.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 178.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.547 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.4 t -69.83 108.77 2.21 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.003 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.537 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.8 p -77.42 162.86 26.89 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.4 t0 73.16 -43.74 0.57 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.4 mt -92.73 -36.67 12.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 78.53 18.17 1.02 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -93.04 -178.94 4.95 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.834 -1.166 . . . . 0.0 109.436 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -137.93 113.87 9.9 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.2 t -110.58 152.37 12.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 CA-C-O 121.59 0.71 . . . . 0.0 109.45 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.82 130.52 38.05 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -114.22 112.98 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.687 -0.633 . . . . 0.0 109.39 -179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -59.79 105.63 0.4 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 m -135.37 -170.39 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 CA-C-O 121.812 0.815 . . . . 0.0 110.13 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.408 ' H ' HG12 ' A' ' 39' ' ' VAL . 8.8 p -142.12 175.03 10.06 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.61 47.87 3.1 Favored Glycine 0 N--CA 1.483 1.799 0 N-CA-C 109.068 -1.613 . . . . 0.0 109.068 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.417 ' O ' ' OE2' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -147.38 -3.57 0.55 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.482 -1.01 . . . . 0.0 108.998 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.408 HG12 ' H ' ' A' ' 36' ' ' THR . 1.3 m -86.55 128.28 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.062 -1.024 . . . . 0.0 110.081 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 43' ' ' GLY . 5.6 m-70 -63.36 149.76 45.04 Favored 'General case' 0 C--N 1.29 -1.992 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.985 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.46 ' C ' ' H ' ' A' ' 43' ' ' GLY . 25.4 mt -49.64 -54.69 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.972 -1.08 . . . . 0.0 108.523 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.06 -12.2 5.34 Favored Glycine 0 C--N 1.299 -1.526 0 N-CA-C 108.139 -1.984 . . . . 0.0 108.139 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -65.69 -27.46 72.68 Favored Glycine 0 N--CA 1.482 1.703 0 N-CA-C 107.357 -2.297 . . . . 0.0 107.357 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -83.68 -44.81 18.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 34.1 mtm -46.96 -37.16 8.61 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -67.48 -65.67 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.347 0.594 . . . . 0.0 110.57 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -53.36 -53.38 51.9 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.391 -0.818 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -45.54 -59.24 2.83 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.723 -1.236 . . . . 0.0 109.687 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 85.1 t -54.25 -51.45 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.849 -1.157 . . . . 0.0 109.749 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -44.79 -40.22 5.92 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.355 -0.841 . . . . 0.0 110.145 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -68.21 -57.57 5.81 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.157 -0.964 . . . . 0.0 111.275 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.406 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.9 OUTLIER -62.11 -66.33 0.56 Allowed 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.82 -1.175 . . . . 0.0 109.014 -179.162 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.0 t70 72.38 82.54 0.14 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.928 0.871 . . . . 0.0 109.914 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.559 ' C ' ' H ' ' A' ' 56' ' ' LYS . 1.7 p -167.05 150.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.146 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.815 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -68.36 35.02 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.499 -0.75 . . . . 0.0 110.139 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.559 ' H ' ' C ' ' A' ' 54' ' ' VAL . 3.2 ttpm? -81.78 155.56 25.38 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.082 -1.011 . . . . 0.0 109.512 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -49.66 112.43 0.65 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.274 -0.891 . . . . 0.0 109.649 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 30.1 m95 -125.09 -30.31 3.22 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.562 -0.711 . . . . 0.0 110.045 -179.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -56.6 13.72 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 120.914 -1.116 . . . . 0.0 110.797 -178.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.43 ' O ' ' O ' ' A' ' 94' ' ' PRO . 15.1 t0 -69.4 -4.0 16.62 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.106 -0.997 . . . . 0.0 110.396 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.99 153.62 40.85 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.133 0.968 . . . . 0.0 110.676 -179.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -167.87 155.52 8.57 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.573 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.6 mm? -93.73 148.42 22.13 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.893 -1.13 . . . . 0.0 109.708 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.524 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.48 148.68 50.31 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.023 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.548 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -107.96 91.45 3.65 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.073 -1.017 . . . . 0.0 108.43 -178.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -55.23 -22.53 18.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.122 -0.986 . . . . 0.0 111.203 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.482 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -65.18 -18.61 65.45 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.177 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.408 ' N ' ' O ' ' A' ' 65' ' ' TRP . 19.3 mmtt -123.95 -13.07 7.43 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.428 -178.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.548 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.54 46.29 26.41 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 -177.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 t -113.49 -172.5 2.08 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.473 0.654 . . . . 0.0 109.851 -178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.475 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.64 104.38 8.35 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 177.672 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.2 mt -62.86 83.95 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.256 0 O-C-N 120.474 -1.391 . . . . 0.0 110.995 -176.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.475 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -119.02 6.73 11.32 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.509 ' C ' ' H ' ' A' ' 76' ' ' HIS . 5.9 mmpt? -76.36 32.76 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.469 ' H ' ' C ' ' A' ' 73' ' ' LEU . 7.2 m -50.52 -10.08 0.06 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.102 -0.999 . . . . 0.0 109.661 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.509 ' H ' ' C ' ' A' ' 74' ' ' LYS . 5.0 t60 -53.47 -65.93 0.48 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.233 -0.917 . . . . 0.0 109.265 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -85.73 -143.16 0.1 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.572 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.576 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -130.47 169.67 15.22 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.535 ' H ' ' CD2' ' A' ' 79' ' ' LEU . 1.5 pt? -60.19 -50.34 74.04 Favored 'General case' 0 C--N 1.287 -2.142 0 O-C-N 121.327 -0.858 . . . . 0.0 109.952 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.422 ' H ' HD21 ' A' ' 79' ' ' LEU . 19.9 t70 -43.89 -35.89 2.17 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-O 122.19 0.995 . . . . 0.0 109.124 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.576 ' CG ' ' H ' ' A' ' 78' ' ' THR . 44.5 mmtt -65.12 -51.35 61.76 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -44.89 95.71 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 115.14 37.29 1.13 Allowed Glycine 0 N--CA 1.511 3.695 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.543 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 56.8 mt -92.96 161.98 2.46 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -165.01 -166.03 0.97 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.259 -0.9 . . . . 0.0 109.465 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.92 -22.08 64.18 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.461 -0.774 . . . . 0.0 109.784 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -5.48 58.15 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.31 -0.869 . . . . 0.0 108.779 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.33 112.44 24.62 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.537 -0.727 . . . . 0.0 109.196 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -97.2 115.4 27.52 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.996 -1.065 . . . . 0.0 109.61 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.1 mt -93.42 176.18 6.48 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.524 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 5.0 mt-30 -135.19 157.15 47.66 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.476 ' CD2' ' C ' ' A' ' 92' ' ' PHE . 0.6 OUTLIER -105.76 131.86 52.6 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.365 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.8 151.86 50.69 Favored Pre-proline 0 N--CA 1.5 2.052 0 O-C-N 120.95 -1.094 . . . . 0.0 109.196 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' A' ' 60' ' ' ASP . 74.3 Cg_endo . . . . . 0 N--CA 1.495 1.603 0 C-N-CA 122.375 2.05 . . . . 0.0 111.65 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -68.94 -101.81 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.232 -0.917 . . . . 0.0 109.488 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.484 ' O ' ' N ' ' B' ' 545' ' ' ARG . 2.1 pp20? -140.57 -0.44 1.56 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.284 -0.885 . . . . 0.0 109.637 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.457 ' CG ' HH21 ' B' ' 544' ' ' ARG . 0.0 OUTLIER -66.34 68.44 0.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.196 -0.94 . . . . 0.0 109.457 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.494 ' HG2' HH21 ' B' ' 545' ' ' ARG . 0.3 OUTLIER -83.08 -148.06 0.09 Allowed 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.264 -0.898 . . . . 0.0 109.382 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -159.95 -98.76 0.14 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.6 m -171.89 120.42 0.45 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.333 -1.098 . . . . 0.0 108.113 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.68 134.68 57.32 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.808 -1.183 . . . . 0.0 110.216 -178.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.37 104.03 13.21 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 178.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.6 t -50.88 127.03 17.55 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 122.174 0.988 . . . . 0.0 109.668 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.59 -34.65 5.35 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 106.081 -2.807 . . . . 0.0 106.081 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -105.58 -35.94 7.27 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.2 mm-40 55.07 56.39 6.61 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.73 1.252 . . . . 0.0 109.914 -178.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -140.57 123.7 10.09 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -44.31 134.83 9.0 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 CA-C-N 120.446 1.195 . . . . 0.0 114.633 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.1 mt -93.9 98.41 8.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.414 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -99.54 91.26 4.82 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.258 -0.901 . . . . 0.0 111.208 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.46 -96.12 0.15 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 107.396 -2.282 . . . . 0.0 107.396 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.472 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.15 151.15 31.23 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.5 p -144.55 126.28 15.2 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.462 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.85 146.62 5.98 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.502 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 8.3 m -117.93 146.77 43.73 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.743 0.782 . . . . 0.0 109.041 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.737 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.51 -129.36 0.26 Allowed 'General case' 0 C--N 1.294 -1.814 0 CA-C-O 121.598 0.713 . . . . 0.0 109.228 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 4.0 mtt -65.84 26.27 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.737 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.33 -9.11 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -81.75 162.58 22.89 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.63 174.97 5.65 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.213 -1.402 . . . . 0.0 107.213 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.99 133.7 6.22 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 117.986 -1.486 . . . . 0.0 110.257 -178.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.594 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.7 m80 -54.32 115.17 7.88 Favored Pre-proline 0 C--N 1.304 -1.393 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 177.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.532 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.1 Cg_exo -45.38 -8.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 CA-C-N 120.278 1.135 . . . . 0.0 112.412 -178.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.594 ' N ' ' O ' ' B' ' 569' ' ' HIS . 8.5 mt-10 -104.11 -53.12 2.8 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 122.154 0.978 . . . . 0.0 109.757 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.449 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.6 m170 -54.73 -5.55 0.09 Allowed 'General case' 0 C--N 1.293 -1.86 0 O-C-N 120.431 -1.418 . . . . 0.0 109.734 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.533 ' H ' ' C ' ' B' ' 571' ' ' GLU . 15.9 t80 -125.45 53.46 1.54 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 12.5 m -93.5 176.75 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.622 -0.674 . . . . 0.0 109.94 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.443 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.12 142.03 36.77 Favored 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.14 74.83 4.04 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 116.58 -2.048 . . . . 0.0 109.774 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.96 -57.87 0.15 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 101.655 -3.461 . . . . 0.0 101.655 172.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.552 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.1 p -122.39 78.48 1.51 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 111.922 -2.399 . . . . 0.0 104.738 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.8 mp -52.01 16.3 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -176.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.552 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.37 -37.42 21.56 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 119.476 -2.015 . . . . 0.0 112.328 -178.406 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.532 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -161.32 143.39 11.97 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 119.474 -2.016 . . . . 0.0 114.199 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.443 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.7 tp -138.95 170.69 15.53 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.452 ' O ' ' N ' ' B' ' 587' ' ' PHE . 69.0 m-20 -146.56 137.87 24.37 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.263 -0.898 . . . . 0.0 109.394 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.502 ' CE ' ' H ' ' B' ' 562' ' ' THR . 6.1 ptpp? -55.29 -22.43 18.67 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.582 0.706 . . . . 0.0 110.09 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.05 -17.06 59.96 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -131.18 23.56 4.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.967 -0.725 . . . . 0.0 109.344 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.538 ' O ' ' CG ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.7 113.02 25.0 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 122.235 1.017 . . . . 0.0 109.341 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -107.25 165.0 11.7 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 179.022 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.45 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.4 tt0 -152.13 156.99 40.93 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.719 1.247 . . . . 0.0 110.47 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.642 ' NE2' ' CE2' ' B' ' 600' ' ' PHE . 0.0 OUTLIER -160.96 146.55 14.44 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.589 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.37 22.82 0.5 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.749 -1.219 . . . . 0.0 109.425 -178.718 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.0 m-20 79.91 -6.38 1.77 Allowed 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.636 -0.665 . . . . 0.0 111.448 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . 0.52 ' O ' ' CE1' ' B' ' 595' ' ' TYR . 33.3 mttm -88.96 115.89 64.8 Favored Pre-proline 0 C--N 1.294 -1.832 0 O-C-N 121.064 -1.022 . . . . 0.0 110.121 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.562 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.0 Cg_exo -51.54 163.14 1.23 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 119.998 1.035 . . . . 0.0 112.369 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.562 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 66.4 m-85 -169.78 142.31 2.44 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.449 -0.782 . . . . 0.0 110.099 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 5.9 m -67.42 154.86 40.38 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.43 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.07 -58.01 10.54 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -48.29 -24.96 1.35 Allowed 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.629 -0.669 . . . . 0.0 110.025 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 1.4 m -77.08 -65.69 0.92 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.23 -0.919 . . . . 0.0 110.432 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.642 ' CE2' ' NE2' ' B' ' 590' ' ' GLN . 2.1 t80 -70.81 -40.49 72.45 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.848 -1.157 . . . . 0.0 111.261 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.472 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -52.11 -42.94 63.68 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -54.84 -25.33 27.83 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . 0.5 ' N ' ' O ' ' B' ' 600' ' ' PHE . 11.6 mt -95.29 -57.95 2.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.477 -0.764 . . . . 0.0 111.652 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.494 ' CD1' ' CE2' ' B' ' 600' ' ' PHE . 13.0 m-85 -100.81 32.62 3.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.97 -1.082 . . . . 0.0 110.268 -179.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 109.698 179.526 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ttm . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.433 ' O ' ' O ' ' A' ' 7' ' ' ARG . . . -147.79 -55.81 0.23 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.992 -1.067 . . . . 0.0 108.803 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.599 ' C ' ' H ' ' A' ' 5' ' ' GLY . 57.7 mt -43.92 -80.0 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.916 0.865 . . . . 0.0 109.694 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.1 t0 61.43 -6.88 0.11 Allowed 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.725 -179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.599 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 115.84 -12.0 17.89 Favored Glycine 0 N--CA 1.493 2.45 0 N-CA-C 108.359 -1.896 . . . . 0.0 108.359 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.485 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -116.71 -106.4 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -178.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.547 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -153.95 -97.83 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 120.623 -1.298 . . . . 0.0 109.922 -179.203 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.565 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -140.58 -61.2 0.02 OUTLIER Pre-proline 0 N--CA 1.503 2.191 0 O-C-N 120.993 -1.067 . . . . 0.0 110.162 -179.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.441 ' O ' ' O ' ' A' ' 13' ' ' TYR . 65.4 Cg_exo -44.9 -35.18 9.62 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 CA-C-N 121.119 1.436 . . . . 0.0 109.911 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -111.67 -25.15 9.67 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.03 9.41 74.75 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.565 ' N ' ' O ' ' A' ' 8' ' ' MET . 51.8 t -156.62 -70.61 0.1 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.266 -1.138 . . . . 0.0 110.631 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.457 ' CG ' ' O ' ' A' ' 12' ' ' CYS . 24.5 m-85 -162.31 -86.39 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.991 -1.068 . . . . 0.0 109.591 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -174.08 -36.49 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -152.17 8.14 0.47 Allowed 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.88 11.34 85.31 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 108.506 -1.838 . . . . 0.0 108.506 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.459 ' O ' ' CG2' ' A' ' 17' ' ' THR . 4.8 t -103.57 122.43 44.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.752 -0.852 . . . . 0.0 109.736 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.512 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -119.2 128.19 53.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.513 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.11 136.19 36.48 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.375 -0.828 . . . . 0.0 110.074 -179.392 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.492 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.45 132.78 34.16 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.319 -1.364 . . . . 0.0 107.319 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.96 145.49 36.03 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.788 -1.195 . . . . 0.0 108.234 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.9 t -140.46 115.96 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.719 0.771 . . . . 0.0 110.303 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -88.6 103.69 16.15 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.574 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -68.96 108.31 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.567 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.3 p -75.62 -55.94 5.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.274 -0.891 . . . . 0.0 110.566 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.546 ' CB ' ' NE2' ' A' ' 61' ' ' HIS . 25.6 t0 -58.24 1.06 0.06 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.039 -1.038 . . . . 0.0 109.824 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.567 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.6 mt -134.51 -25.09 1.52 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.341 -0.849 . . . . 0.0 109.433 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.14 14.26 2.53 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.923 -0.486 . . . . 0.0 110.199 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -94.04 -178.07 4.52 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.871 -1.143 . . . . 0.0 109.836 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -136.76 119.12 15.71 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.1 t -122.54 157.8 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-O 121.658 0.742 . . . . 0.0 110.065 -178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.07 133.42 42.97 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -115.27 113.12 23.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.618 -0.676 . . . . 0.0 110.151 -179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.423 ' CA ' ' HE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -58.52 114.05 2.29 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.001 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.4 m -140.88 -170.2 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-O 121.967 0.889 . . . . 0.0 110.498 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.5 p -144.18 175.3 10.17 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.92 43.79 3.03 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -145.25 5.14 1.09 Allowed 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.6 m -89.97 136.81 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.015 -1.053 . . . . 0.0 109.993 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m-70 -75.31 141.87 43.33 Favored 'General case' 0 C--N 1.292 -1.924 0 O-C-N 120.96 -1.088 . . . . 0.0 108.232 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.489 ' C ' ' H ' ' A' ' 43' ' ' GLY . 32.3 mt -47.07 -57.99 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.001 -1.062 . . . . 0.0 109.654 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.05 -13.49 3.56 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 108.143 -1.983 . . . . 0.0 108.143 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.6 -28.89 64.52 Favored Glycine 0 N--CA 1.485 1.944 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.8 t -83.74 -39.01 14.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.7 mtm -46.47 -39.88 11.43 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.33 -58.1 3.43 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.52 -0.737 . . . . 0.0 110.535 -178.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 39.0 mttm -47.89 -59.34 3.41 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.775 -1.203 . . . . 0.0 109.893 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 36.0 tp -45.75 -38.28 6.85 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.337 -0.852 . . . . 0.0 109.391 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 81.4 t -78.37 -42.39 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.155 -0.966 . . . . 0.0 109.403 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.429 ' O ' ' OD1' ' A' ' 53' ' ' ASP . 39.5 mm-40 -46.54 -39.92 11.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.272 -0.892 . . . . 0.0 109.276 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.485 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.0 mtmp? -74.78 -34.01 62.37 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.52 -69.02 0.51 Allowed 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 50' ' ' GLU . 91.2 m-20 52.8 68.09 0.89 Allowed 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.17 0.509 . . . . 0.0 109.725 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.537 ' O ' ' N ' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -136.42 32.06 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 122.0 0.905 . . . . 0.0 109.927 -178.775 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.1 tptt 41.66 19.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.732 -0.605 . . . . 0.0 110.647 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.537 ' N ' ' O ' ' A' ' 54' ' ' VAL . 28.3 ttmt -75.65 151.37 37.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.826 -1.171 . . . . 0.0 107.939 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 57' ' ' ASP . 0.7 OUTLIER -53.59 89.78 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.405 -0.809 . . . . 0.0 108.925 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.528 ' N ' ' O ' ' A' ' 56' ' ' LYS . 10.7 m0 -78.3 -43.47 27.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.537 ' C ' ' H ' ' A' ' 61' ' ' HIS . 32.2 t -54.2 -48.69 70.72 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.609 -0.682 . . . . 0.0 109.249 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -59.59 -1.41 0.24 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.387 -0.82 . . . . 0.0 109.16 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.546 ' NE2' ' CB ' ' A' ' 26' ' ' ASP . 14.9 m80 -123.18 147.93 46.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.619 -0.676 . . . . 0.0 109.477 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.511 ' H ' ' C ' ' A' ' 93' ' ' THR . . . -156.38 179.35 9.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.384 -0.822 . . . . 0.0 108.828 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.528 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 2.9 mm? -94.92 140.43 29.95 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.02 -1.05 . . . . 0.0 110.502 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.495 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -134.67 146.6 49.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.534 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.5 t90 -105.82 91.34 3.7 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.938 -1.101 . . . . 0.0 108.751 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 9.7 pt-20 -55.92 -22.52 26.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.968 . . . . 0.0 110.811 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -64.9 -18.09 64.9 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 178.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -125.45 -11.37 6.84 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.303 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.534 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.2 mpp_? 53.34 47.38 24.34 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 -178.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -115.14 -170.75 1.82 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.45 0.643 . . . . 0.0 110.033 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -124.28 99.83 6.41 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 177.081 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.0 86.5 0.01 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.676 -1.265 . . . . 0.0 110.895 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.541 ' C ' ' H ' ' A' ' 75' ' ' THR . 3.1 pp -121.35 4.33 10.26 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -69.82 35.09 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.062 -1.024 . . . . 0.0 109.306 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.541 ' H ' ' C ' ' A' ' 73' ' ' LEU . 21.8 m -51.73 -7.18 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.684 -1.26 . . . . 0.0 109.849 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.541 ' H ' ' C ' ' A' ' 74' ' ' LYS . 1.1 t60 -50.31 -73.14 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.183 -0.948 . . . . 0.0 110.2 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -90.64 -112.43 0.08 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.083 -1.011 . . . . 0.0 109.961 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.83 -163.39 1.7 Allowed 'General case' 0 N--CA 1.504 2.233 0 O-C-N 119.563 -1.961 . . . . 0.0 111.445 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.528 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.8 mp -70.51 -57.27 4.94 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -42.68 -45.68 4.79 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.127 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.489 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.489 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -83.18 -47.94 11.04 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.38 7.17 12.56 Favored Glycine 0 N--CA 1.501 3.012 0 N-CA-C 108.547 -1.821 . . . . 0.0 108.547 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.515 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 36.9 mt -61.15 160.49 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -154.15 -164.42 1.85 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 108.986 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -75.25 -17.28 60.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.348 -0.845 . . . . 0.0 109.772 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.06 3.85 50.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.492 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.02 113.34 25.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.284 -0.885 . . . . 0.0 108.981 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -96.03 123.63 39.72 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.001 -1.062 . . . . 0.0 109.994 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.6 mt -106.46 177.94 4.71 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.771 0.795 . . . . 0.0 109.123 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.495 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.0 mt-30 -131.87 165.36 24.04 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -117.05 91.34 3.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.511 ' C ' ' H ' ' A' ' 62' ' ' ALA . 0.3 OUTLIER -146.21 161.74 37.88 Favored Pre-proline 0 N--CA 1.497 1.919 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -178.527 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.49 1.275 0 C-N-CA 122.385 2.056 . . . . 0.0 111.761 179.712 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 79.4 t80 . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -60.52 -171.98 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.325 -0.859 . . . . 0.0 109.796 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -107.59 -33.62 7.26 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.465 ' CD ' ' H ' ' B' ' 544' ' ' ARG . 0.0 OUTLIER -81.34 92.11 6.35 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.238 -0.914 . . . . 0.0 109.706 -179.824 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.449 ' CG ' HH21 ' B' ' 545' ' ' ARG . 0.0 OUTLIER -72.11 -158.19 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.215 -0.928 . . . . 0.0 109.421 179.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -147.55 -99.15 0.22 Allowed Glycine 0 N--CA 1.495 2.581 0 N-CA-C 109.217 -1.553 . . . . 0.0 109.217 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m -159.5 116.64 2.65 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.67 135.58 57.68 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 120.949 -1.094 . . . . 0.0 110.259 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.38 103.5 12.79 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.3 t -50.22 126.1 13.99 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-O 122.153 0.978 . . . . 0.0 109.628 -177.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.17 5.6 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 106.304 -2.718 . . . . 0.0 106.304 -177.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.1 m -105.94 -35.82 7.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.427 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.0 mm-40 55.16 56.22 6.74 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 122.658 1.218 . . . . 0.0 110.004 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp -140.79 124.21 10.13 Favored Pre-proline 0 C--N 1.293 -1.853 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -44.38 136.05 8.69 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.447 1.195 . . . . 0.0 114.612 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.0 mt -95.37 98.26 7.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.41 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -100.11 90.72 4.47 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.259 -0.901 . . . . 0.0 111.169 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.01 -95.87 0.15 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.405 -2.278 . . . . 0.0 107.405 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.458 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.5 mmt180 -113.15 149.52 33.48 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.34 126.36 15.47 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.984 -1.073 . . . . 0.0 111.455 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.9 mt -91.14 146.86 5.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.682 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.9 m -117.28 146.96 42.98 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.766 0.793 . . . . 0.0 109.131 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.743 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.67 -129.3 0.26 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.551 0.691 . . . . 0.0 109.401 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.55 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.2 mtt -65.78 26.26 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.743 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.2 -8.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 -178.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -81.42 164.45 22.06 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -106.94 174.5 5.86 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.88 137.57 8.72 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.104 -1.438 . . . . 0.0 110.005 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.603 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.3 m80 -57.11 116.01 12.23 Favored Pre-proline 0 C--N 1.3 -1.574 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 177.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.55 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.9 Cg_exo -43.9 -9.38 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.391 0 CA-C-N 120.129 1.082 . . . . 0.0 112.755 -178.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.603 ' N ' ' O ' ' B' ' 569' ' ' HIS . 6.9 mt-10 -105.26 -52.85 2.76 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.197 -0.939 . . . . 0.0 110.037 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.449 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 13.3 m170 -55.79 -4.97 0.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.822 -1.174 . . . . 0.0 109.75 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.522 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.2 t80 -122.26 52.15 1.32 Allowed 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . 0.408 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 18.7 m -92.53 177.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.396 0 CA-C-O 121.58 0.705 . . . . 0.0 109.218 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -79.74 145.83 32.68 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.476 -0.765 . . . . 0.0 109.088 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . 0.464 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -93.55 77.16 4.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 117.019 -1.873 . . . . 0.0 108.809 178.023 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -151.28 -45.96 0.11 Allowed 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 101.802 -3.407 . . . . 0.0 101.802 174.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.8 OUTLIER -126.83 154.98 43.61 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 111.677 -2.511 . . . . 0.0 105.314 177.559 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . 0.648 ' H ' ' CD2' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -104.74 14.32 29.89 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.659 -1.276 . . . . 0.0 111.281 -178.288 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.424 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -100.28 -39.25 8.12 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-N 120.909 1.686 . . . . 0.0 115.502 -176.181 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.57 142.44 9.48 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 122.29 2.314 . . . . 0.0 115.846 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.439 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 24.2 tp -136.91 169.75 17.24 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 174.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.446 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.0 m-20 -147.32 129.66 15.73 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.992 -1.067 . . . . 0.0 109.299 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.682 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 4.0 ptpp? -51.17 -17.72 0.73 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.539 -0.726 . . . . 0.0 109.753 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.29 -20.81 51.28 Favored Glycine 0 N--CA 1.487 2.072 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 586' ' ' THR . . . . . 0.428 ' N ' ' O ' ' B' ' 583' ' ' ASN . 2.3 p -133.88 28.11 3.89 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.582 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.6 OUTLIER -89.64 106.98 18.82 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.736 1.255 . . . . 0.0 109.836 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.72 167.71 10.61 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 179.486 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -152.08 157.27 41.39 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 122.634 1.207 . . . . 0.0 110.721 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.546 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 2.1 tp60 -154.87 146.12 22.88 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.497 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.24 23.89 0.13 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.969 -1.082 . . . . 0.0 110.111 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.483 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.5 m-20 81.66 -4.9 1.57 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.598 -0.689 . . . . 0.0 110.809 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -89.15 121.69 69.33 Favored Pre-proline 0 C--N 1.294 -1.827 0 O-C-N 121.296 -0.878 . . . . 0.0 109.457 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.48 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.7 Cg_exo -48.71 164.82 0.2 Allowed 'Trans proline' 0 N--CA 1.489 1.227 0 CA-C-N 119.945 1.016 . . . . 0.0 111.809 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.2 m-85 -170.51 141.48 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.626 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 20.6 m -76.16 155.74 34.32 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 104.455 -2.424 . . . . 0.0 104.455 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.453 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.77 -57.82 11.08 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 117.293 -1.763 . . . . 0.0 106.383 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.03 -29.09 1.34 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.503 -0.748 . . . . 0.0 109.359 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.8 m -80.89 -64.82 1.11 Allowed 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -53.35 -53.37 52.08 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.672 -0.642 . . . . 0.0 109.988 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.576 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -48.52 -42.34 32.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.092 -1.005 . . . . 0.0 108.776 -179.167 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 26.3 tptt -61.36 -20.4 62.95 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.38 -0.825 . . . . 0.0 110.26 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 7.7 mt -91.68 -56.29 3.16 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.69 -1.257 . . . . 0.0 110.409 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.546 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 3.8 m-85 -93.16 9.3 36.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.991 -1.068 . . . . 0.0 109.618 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 12.0 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.302 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 43.4 ttm . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.67 -45.08 0.24 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.755 -1.215 . . . . 0.0 108.323 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.582 ' CD1' ' H ' ' A' ' 3' ' ' LEU . 5.3 mp -63.7 -68.19 0.37 Allowed 'General case' 0 C--N 1.297 -1.699 0 CA-C-O 122.125 0.964 . . . . 0.0 109.226 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.422 ' O ' ' OD2' ' A' ' 4' ' ' ASP . 50.9 t0 -75.96 17.13 0.35 Allowed 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.512 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -61.5 -13.65 38.61 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 107.755 -2.138 . . . . 0.0 107.755 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.555 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -111.28 -95.25 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.24 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.577 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -152.03 -98.5 0.05 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.108 -0.995 . . . . 0.0 109.697 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.577 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -145.92 -62.99 0.02 OUTLIER Pre-proline 0 N--CA 1.5 2.042 0 O-C-N 120.985 -1.072 . . . . 0.0 110.816 -179.215 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -44.66 -35.8 9.61 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 CA-C-N 121.224 1.473 . . . . 0.0 110.071 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -111.57 -26.05 9.24 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.487 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.77 7.76 81.16 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.535 ' N ' ' O ' ' A' ' 8' ' ' MET . 18.5 t -165.85 -28.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.249 -1.147 . . . . 0.0 110.327 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.516 ' O ' ' CB ' ' A' ' 14' ' ' ALA . 84.5 m-85 52.88 -105.01 0.22 Allowed 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.516 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 159.12 -40.4 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -164.98 10.32 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.765 -0.774 . . . . 0.0 109.942 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.529 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 75.9 45.56 16.21 Favored Glycine 0 N--CA 1.488 2.147 0 N-CA-C 107.558 -2.217 . . . . 0.0 107.558 -178.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 p -75.66 121.92 23.2 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.006 0.908 . . . . 0.0 110.726 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -141.35 124.07 16.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 178.676 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.87 130.97 40.98 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.59 -1.319 . . . . 0.0 109.872 -179.173 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.478 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.55 130.68 34.71 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 179.107 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.78 146.15 33.95 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.331 -0.855 . . . . 0.0 109.818 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.493 ' CG1' ' N ' ' A' ' 23' ' ' HIS . 25.1 t -132.4 156.82 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-O 122.388 1.09 . . . . 0.0 110.042 178.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.538 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 15.7 m80 -128.42 98.91 5.21 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 104.195 -2.521 . . . . 0.0 104.195 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.56 ' O ' ' N ' ' A' ' 28' ' ' ASN . 9.0 t -73.15 94.35 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 C-N-CA 119.026 -1.07 . . . . 0.0 109.149 -178.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.528 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -64.99 169.08 5.64 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.742 -1.206 . . . . 0.0 107.742 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 0.9 OUTLIER 73.01 -45.52 0.62 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.528 ' H ' ' C ' ' A' ' 25' ' ' THR . 9.1 tp -92.15 -32.62 15.05 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.56 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 73.05 9.91 5.32 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.447 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.433 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 60.0 mtp180 -87.03 -179.79 6.54 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 120.53 -1.356 . . . . 0.0 108.947 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.538 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 1.0 OUTLIER -143.04 123.05 13.57 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.875 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.6 t -127.69 158.64 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 CA-C-O 121.415 0.626 . . . . 0.0 110.771 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.34 139.95 53.52 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -119.73 113.33 20.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.536 -0.727 . . . . 0.0 109.89 -178.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -60.41 104.35 0.32 Allowed 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.5 m -129.17 -169.03 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 122.01 0.909 . . . . 0.0 110.566 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.407 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.1 p -143.39 166.32 25.09 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.452 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -76.84 48.08 2.61 Favored Glycine 0 N--CA 1.485 1.937 0 C-N-CA 119.133 -1.508 . . . . 0.0 109.572 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.407 ' H ' ' C ' ' A' ' 36' ' ' THR . 1.1 pp20? -153.59 2.43 0.27 Allowed 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.641 -0.917 . . . . 0.0 109.172 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 m -81.33 139.62 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 120.892 -1.13 . . . . 0.0 109.187 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.485 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m80 -79.09 140.74 37.78 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.416 ' C ' ' H ' ' A' ' 43' ' ' GLY . 74.3 mt -46.9 -57.31 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.156 -0.965 . . . . 0.0 109.476 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.77 -10.26 8.15 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.399 -1.481 . . . . 0.0 109.399 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.485 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -80.69 -24.26 58.68 Favored Glycine 0 N--CA 1.481 1.671 0 N-CA-C 106.51 -2.636 . . . . 0.0 106.51 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 45' ' ' MET . 0.4 OUTLIER -73.48 -55.65 11.89 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 114.681 -0.759 . . . . 0.0 109.094 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.534 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 39.7 mtm -46.22 -32.04 2.81 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.26 -0.9 . . . . 0.0 108.942 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tt -71.65 -28.9 64.07 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.12 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -88.82 -59.26 2.28 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.125 -1.609 . . . . 0.0 111.748 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.69 -55.78 6.03 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.762 -1.211 . . . . 0.0 109.001 -178.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 72.7 t -51.81 -50.82 31.06 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 C-N-CA 119.931 -0.708 . . . . 0.0 109.875 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -47.68 -41.13 21.81 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.914 -1.116 . . . . 0.0 109.566 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -68.11 -38.45 82.28 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.289 -0.882 . . . . 0.0 109.861 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.422 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -66.51 -69.44 0.3 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.17 -0.956 . . . . 0.0 108.829 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.422 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 7.7 t70 75.07 83.29 0.1 Allowed 'General case' 0 N--CA 1.488 1.438 0 CA-C-O 121.977 0.894 . . . . 0.0 109.977 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.562 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.0 p -168.77 150.89 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.977 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.63 27.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.524 -0.735 . . . . 0.0 109.448 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.562 ' H ' ' C ' ' A' ' 54' ' ' VAL . 9.0 ttpp -78.75 147.36 33.41 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.902 -1.124 . . . . 0.0 109.634 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -69.48 112.53 6.07 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.543 -0.723 . . . . 0.0 109.249 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.601 ' CA ' ' HD1' ' A' ' 61' ' ' HIS . 79.3 m95 -108.39 -42.78 4.49 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.462 -0.774 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.8 t -45.45 -55.09 6.51 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 109.643 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -51.03 -33.98 27.67 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.601 ' HD1' ' CA ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -71.41 115.46 10.61 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 121.943 0.878 . . . . 0.0 109.261 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -121.15 164.28 17.13 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.57 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -93.87 141.16 28.83 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.882 -1.136 . . . . 0.0 110.97 -177.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.511 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.34 140.99 51.57 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -101.85 91.84 4.55 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -55.56 -21.99 19.69 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.122 -0.986 . . . . 0.0 111.005 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.488 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -65.62 -19.38 65.89 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 105.647 -1.982 . . . . 0.0 105.647 178.154 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -123.22 -12.66 7.84 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.441 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 53.9 45.36 27.91 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -177.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -112.64 -173.93 2.35 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.492 0.663 . . . . 0.0 110.032 -178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.33 5.59 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.602 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 15.8 mt -62.05 84.1 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.122 0 O-C-N 120.231 -1.543 . . . . 0.0 110.278 -176.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -113.6 14.02 18.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.565 ' NZ ' ' CZ ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -85.48 66.44 9.68 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.807 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.9 m -64.99 -6.7 9.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.0 109.776 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -84.43 -35.82 22.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.164 -0.96 . . . . 0.0 110.07 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.0 m95 -91.65 -160.25 0.71 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.115 -0.991 . . . . 0.0 109.505 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.615 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -150.01 169.18 21.81 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 122.086 0.946 . . . . 0.0 109.238 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.433 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 9.1 mp -43.65 -63.81 0.77 Allowed 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.994 0.902 . . . . 0.0 109.257 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -43.01 -51.37 5.71 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.875 0.845 . . . . 0.0 110.075 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.615 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -45.44 -53.92 8.09 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-O 121.617 0.723 . . . . 0.0 109.794 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.565 ' CZ ' ' NZ ' ' A' ' 74' ' ' LYS . 10.5 m-85 -77.33 -40.21 44.98 Favored 'General case' 0 C--N 1.298 -1.653 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.524 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.21 10.47 10.75 Favored Glycine 0 N--CA 1.5 2.952 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.535 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.4 mt -61.09 160.19 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 O-C-N 121.537 -0.978 . . . . 0.0 108.937 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.535 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.83 -167.13 0.47 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.364 -0.835 . . . . 0.0 109.359 -179.38 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.63 -23.79 66.22 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 110.169 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -78.51 -8.03 58.12 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.237 -0.914 . . . . 0.0 108.673 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.69 26.23 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.5 mmtp -93.17 119.92 32.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.992 -1.067 . . . . 0.0 109.067 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.7 mt -99.32 176.03 5.67 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 121.795 0.807 . . . . 0.0 110.5 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.511 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.1 mt-30 -133.63 147.44 51.47 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.417 ' CD2' HD12 ' A' ' 63' ' ' LEU . 4.2 m-85 -113.27 97.64 6.61 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.16 152.49 15.84 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.298 -0.876 . . . . 0.0 111.28 -177.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo . . . . . 0 N--CA 1.493 1.47 0 C-N-CA 122.899 2.399 . . . . 0.0 112.447 178.444 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.363 0.602 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . 0.522 ' O ' ' N ' ' B' ' 544' ' ' ARG . 2.2 m80 -77.69 -54.89 5.83 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.306 -0.871 . . . . 0.0 109.407 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -43.27 -17.96 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.591 -0.693 . . . . 0.0 110.416 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' B' ' 542' ' ' HIS . 17.3 mmt180 -78.38 87.02 4.42 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.065 -1.022 . . . . 0.0 109.415 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.462 ' CD ' ' H ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -130.33 -41.87 1.22 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.377 -0.827 . . . . 0.0 109.759 -179.312 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . 0.462 ' H ' ' CD ' ' B' ' 545' ' ' ARG . . . -50.93 -106.66 0.01 OUTLIER Glycine 0 N--CA 1.494 2.551 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m -165.36 118.13 1.17 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.192 -1.181 . . . . 0.0 108.11 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.69 135.66 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.883 -1.135 . . . . 0.0 110.271 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.62 103.93 13.34 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 105.811 -1.922 . . . . 0.0 105.811 178.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.7 t -50.62 126.79 16.41 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.124 0.964 . . . . 0.0 109.727 -177.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.92 5.17 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 106.208 -2.757 . . . . 0.0 106.208 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.34 -35.85 7.39 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.416 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.3 mm-40 55.68 56.4 6.2 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 122.656 1.217 . . . . 0.0 110.138 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -140.49 123.45 10.03 Favored Pre-proline 0 C--N 1.293 -1.865 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -44.29 134.99 8.9 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 120.534 1.227 . . . . 0.0 114.485 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.5 mt -93.92 98.2 7.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 24.7 p -100.07 91.13 4.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.228 -0.92 . . . . 0.0 111.333 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.17 -97.07 0.16 Allowed Glycine 0 N--CA 1.486 2.028 0 N-CA-C 107.063 -2.415 . . . . 0.0 107.063 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.464 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 0.9 OUTLIER -111.94 150.64 30.23 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 177.878 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.32 125.78 14.89 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.227 1.013 . . . . 0.0 111.411 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.0 mt -91.09 147.41 5.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.719 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 8.7 m -118.14 146.93 43.8 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 121.786 0.803 . . . . 0.0 109.072 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.22 -129.14 0.26 Allowed 'General case' 0 C--N 1.295 -1.768 0 CA-C-O 121.593 0.711 . . . . 0.0 109.359 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.6 mtt -65.65 26.28 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.21 -9.16 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -178.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -82.28 162.17 22.38 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -103.9 174.31 5.93 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -159.75 138.55 10.75 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 118.211 -1.395 . . . . 0.0 109.861 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.605 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.6 m80 -57.89 116.99 16.22 Favored Pre-proline 0 C--N 1.299 -1.63 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.545 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 53.1 Cg_exo -45.38 -9.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.403 0 CA-C-N 120.33 1.154 . . . . 0.0 111.793 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.605 ' N ' ' O ' ' B' ' 569' ' ' HIS . 7.9 mt-10 -100.02 -52.33 3.45 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.155 0.979 . . . . 0.0 109.977 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -58.21 -3.35 0.25 Allowed 'General case' 0 C--N 1.293 -1.884 0 O-C-N 120.696 -1.252 . . . . 0.0 109.9 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.498 ' H ' ' C ' ' B' ' 571' ' ' GLU . 31.2 t80 -127.68 57.53 1.52 Allowed 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . 0.425 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.48 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.717 0.77 . . . . 0.0 111.403 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.466 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.86 146.12 35.86 Favored 'General case' 0 N--CA 1.504 2.266 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.36 74.69 3.33 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 116.623 -2.031 . . . . 0.0 109.974 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -63.66 0.14 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 101.962 -3.347 . . . . 0.0 101.962 172.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.2 p -114.22 80.42 1.39 Allowed 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 112.356 -2.202 . . . . 0.0 105.108 176.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.2 16.99 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 -176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.05 -36.23 17.08 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 119.687 -1.883 . . . . 0.0 112.691 -178.606 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.545 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.6 tp60 -159.47 139.59 11.9 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 119.295 -2.128 . . . . 0.0 115.138 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.466 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 19.2 tp -141.33 168.83 18.85 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.43 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 63.9 m-20 -148.25 140.24 23.99 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -0.965 . . . . 0.0 109.092 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.719 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 4.6 ptpp? -57.6 -19.65 27.35 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.394 -0.816 . . . . 0.0 109.636 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.3 -17.22 57.72 Favored Glycine 0 N--CA 1.485 1.96 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.11 25.35 4.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.943 -0.739 . . . . 0.0 109.422 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.519 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.12 114.45 26.39 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-O 122.283 1.04 . . . . 0.0 109.408 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -106.16 167.1 10.04 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 179.074 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.7 tt0 -153.48 157.54 40.0 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.618 -1.301 . . . . 0.0 111.323 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.54 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.2 tp-100 -156.81 146.21 20.5 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 178.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.589 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 47.07 23.55 0.3 Allowed 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.939 -1.101 . . . . 0.0 109.609 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.9 m-20 81.51 -6.0 1.54 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.759 -0.588 . . . . 0.0 110.973 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -88.17 118.1 69.17 Favored Pre-proline 0 C--N 1.295 -1.789 0 O-C-N 121.16 -0.963 . . . . 0.0 110.005 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.542 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.1 Cg_exo -49.87 164.45 0.4 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 CA-C-N 119.988 1.031 . . . . 0.0 111.855 179.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.542 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.73 137.98 1.36 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.276 -0.89 . . . . 0.0 109.877 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.06 156.6 35.66 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.436 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.61 -56.4 20.24 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 178.526 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.46 -28.63 0.94 Allowed 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 21.1 m -84.14 -65.88 0.96 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.449 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.7 OUTLIER -45.6 -52.29 10.83 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.594 0.712 . . . . 0.0 109.583 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.449 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -59.9 -40.95 90.51 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.574 -0.704 . . . . 0.0 109.393 -178.489 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -57.46 -26.27 60.97 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.157 -0.965 . . . . 0.0 110.25 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -93.73 -56.66 2.82 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.028 -1.045 . . . . 0.0 111.123 -178.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.5 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 0.3 OUTLIER -100.5 -29.62 12.26 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.178 -0.951 . . . . 0.0 110.727 -178.112 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.439 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 2.4 t . . . . . 0 N--CA 1.501 2.102 0 O-C-N 121.048 -1.033 . . . . 0.0 109.682 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ttt . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.94 -52.46 0.1 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 70.8 mt -48.33 -81.33 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 122.211 1.005 . . . . 0.0 109.192 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.408 ' O ' ' CG ' ' A' ' 4' ' ' ASP . 26.2 t70 50.32 18.75 0.45 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-O 121.745 0.783 . . . . 0.0 109.299 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.79 -16.86 48.11 Favored Glycine 0 N--CA 1.485 1.901 0 N-CA-C 107.323 -2.311 . . . . 0.0 107.323 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.539 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -107.07 -94.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -179.527 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.608 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -155.01 -102.45 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.163 -0.96 . . . . 0.0 110.061 -179.827 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.608 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -149.48 -62.47 0.02 OUTLIER Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 120.976 -1.077 . . . . 0.0 111.531 -178.417 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -42.89 -36.59 5.38 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 CA-C-N 121.034 1.405 . . . . 0.0 110.66 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -115.36 -25.23 8.06 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -90.71 11.24 72.34 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.3 -1.52 . . . . 0.0 109.3 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 8' ' ' MET . 49.2 t -164.96 -81.04 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.613 -0.933 . . . . 0.0 110.082 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.491 ' O ' ' CB ' ' A' ' 14' ' ' ALA . 1.6 t80 78.29 -42.25 0.34 Allowed 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -178.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.491 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 163.73 -53.51 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -163.98 4.45 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.63 0 C-N-CA 119.475 -0.89 . . . . 0.0 110.461 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.51 25.66 6.86 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -90.19 122.53 33.21 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.454 -1.027 . . . . 0.0 109.544 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.65 121.44 32.15 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.51 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.7 128.73 35.82 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.073 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.45 135.03 34.83 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.246 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.07 145.85 35.58 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.399 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.7 t -137.81 111.07 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 CA-C-O 121.923 0.868 . . . . 0.0 109.756 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.514 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 6.9 m-70 -85.8 103.59 14.71 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.1 t -73.03 82.8 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 O-C-N 121.159 -0.963 . . . . 0.0 109.192 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.62 166.4 0.93 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.77 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.5 t0 73.48 -46.3 0.63 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.543 ' H ' ' C ' ' A' ' 25' ' ' THR . 0.3 OUTLIER -85.76 -36.34 20.2 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.345 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.532 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 75.72 13.28 2.91 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.339 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 -90.41 -177.81 5.18 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.12 -0.988 . . . . 0.0 109.144 179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.514 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 18.1 m-20 -144.45 116.87 8.54 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 19.9 t -119.41 157.4 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.693 0.759 . . . . 0.0 110.062 -178.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.12 133.01 42.34 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -113.84 113.24 24.63 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.705 -0.622 . . . . 0.0 109.334 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -59.95 105.95 0.45 Allowed 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.1 m -134.25 -169.51 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-O 121.988 0.899 . . . . 0.0 110.4 -178.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.422 ' H ' HG11 ' A' ' 39' ' ' VAL . 5.3 p -142.5 174.64 10.45 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 179.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.09 44.65 2.65 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.414 ' O ' ' OE2' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -145.58 4.07 1.01 Allowed 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.602 -0.94 . . . . 0.0 108.956 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.422 HG11 ' H ' ' A' ' 36' ' ' THR . 2.9 m -88.9 137.72 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.073 -1.017 . . . . 0.0 110.193 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.482 ' O ' ' N ' ' A' ' 43' ' ' GLY . 3.8 m-70 -79.25 144.38 34.39 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.138 -0.976 . . . . 0.0 108.912 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 87.9 mt -45.74 -58.54 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.257 -0.902 . . . . 0.0 110.175 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.07 -13.58 4.93 Favored Glycine 0 C--N 1.296 -1.677 0 N-CA-C 108.734 -1.746 . . . . 0.0 108.734 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.95 -26.33 58.47 Favored Glycine 0 N--CA 1.48 1.621 0 N-CA-C 108.54 -1.824 . . . . 0.0 108.54 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -83.32 -53.95 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.469 -1.018 . . . . 0.0 110.642 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -27.68 44.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.222 -1.549 . . . . 0.0 108.862 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -64.13 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -52.28 -53.99 37.07 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.431 -0.793 . . . . 0.0 110.17 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.5 tp -44.93 -51.52 9.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.508 -0.745 . . . . 0.0 110.098 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.81 -47.13 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.815 -1.178 . . . . 0.0 109.008 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -48.03 -40.62 23.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.275 -0.891 . . . . 0.0 109.474 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -69.21 -43.87 73.23 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.406 -0.809 . . . . 0.0 110.011 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -48.96 -58.1 5.43 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.566 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.4 t70 74.0 75.47 0.12 Allowed 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.938 0.875 . . . . 0.0 110.135 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.542 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -175.16 132.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.292 -1.905 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -69.46 35.86 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.458 -0.776 . . . . 0.0 109.381 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.542 ' H ' ' C ' ' A' ' 54' ' ' VAL . 39.4 tttp -78.95 135.42 36.94 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.628 -1.295 . . . . 0.0 108.681 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.406 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 14.3 t70 -50.02 119.72 3.83 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.223 -0.923 . . . . 0.0 108.958 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 55.1 m95 -120.23 -35.93 3.34 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.58 -0.7 . . . . 0.0 110.539 -179.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 58' ' ' TRP . 8.2 t -43.15 -50.27 6.28 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.293 -0.879 . . . . 0.0 109.164 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -55.52 -43.06 75.38 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.705 ' HD1' ' H ' ' A' ' 61' ' ' HIS . 0.4 OUTLIER -71.16 115.15 9.97 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.582 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -129.56 168.99 15.58 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 91' ' ' GLN . 0.3 OUTLIER -95.71 149.37 21.55 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 122.289 1.042 . . . . 0.0 110.679 -178.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.623 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -141.6 142.87 33.46 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 -178.71 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.541 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -94.96 90.8 6.1 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.292 -1.505 . . . . 0.0 108.955 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.416 ' C ' ' N ' ' A' ' 68' ' ' LYS . 14.3 pt-20 -55.44 -23.46 25.41 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.069 -1.019 . . . . 0.0 110.585 -179.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.467 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 12.6 mmtp -66.53 -10.4 44.57 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.416 ' N ' ' C ' ' A' ' 66' ' ' GLU . 17.7 mmtt -133.29 -11.08 2.87 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.616 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.3 mpp_? 52.73 47.18 25.24 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.503 ' HG1' ' H ' ' A' ' 71' ' ' TRP . 4.0 t -115.43 -172.15 2.09 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.472 0.653 . . . . 0.0 109.834 -178.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.56 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.8 99.21 5.04 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 177.02 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.38 87.72 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.182 0 O-C-N 120.667 -1.271 . . . . 0.0 108.832 -176.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 13.01 12.55 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.96 74.72 9.67 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -25.22 68.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.909 -1.12 . . . . 0.0 108.354 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.48 ' O ' ' CE3' ' A' ' 77' ' ' TRP . 2.8 t60 -82.83 73.71 9.84 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.48 ' CE3' ' O ' ' A' ' 76' ' ' HIS . 0.1 OUTLIER 161.04 -167.77 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 -179.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.642 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -149.44 -172.0 4.03 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.776 -1.202 . . . . 0.0 109.432 -179.756 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.506 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.1 mp -62.49 -58.82 6.24 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -42.95 -50.98 5.77 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.695 0.76 . . . . 0.0 109.874 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.642 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -46.54 -54.39 9.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-O 121.58 0.705 . . . . 0.0 109.684 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -73.71 -41.11 63.04 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.117 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 114.11 8.8 16.83 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 108.131 -1.988 . . . . 0.0 108.131 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 58.9 mt -61.07 157.94 2.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.755 -0.85 . . . . 0.0 109.135 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.16 -165.78 1.04 Allowed 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.61 -24.85 63.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.468 -0.77 . . . . 0.0 110.022 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.4 p30 -78.6 -7.98 58.15 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 108.769 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.61 26.12 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.0 mmtp -93.82 116.02 28.46 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.982 -1.074 . . . . 0.0 110.018 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.2 mt -91.16 176.65 6.51 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.623 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.9 mt-30 -135.6 171.73 14.03 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.54 97.62 3.19 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.417 ' CB ' ' OG1' ' A' ' 25' ' ' THR . 3.0 t -160.99 151.65 15.16 Favored Pre-proline 0 N--CA 1.491 1.582 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.85 -177.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo . . . . . 0 N--CA 1.493 1.455 0 C-N-CA 122.766 2.311 . . . . 0.0 112.408 178.417 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . 0.424 ' C ' ' H ' ' B' ' 544' ' ' ARG . 0.9 OUTLIER -123.35 -52.6 1.83 Allowed 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.877 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.467 ' O ' ' O ' ' B' ' 544' ' ' ARG . 4.0 pt-20 -76.01 9.94 2.17 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.551 ' CG ' HH21 ' B' ' 544' ' ' ARG . 0.1 OUTLIER 37.39 -164.0 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.239 0 CA-C-O 121.179 0.514 . . . . 0.0 111.615 178.977 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.41 -164.55 0.93 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.377 -0.827 . . . . 0.0 110.024 -178.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -91.06 -94.83 1.27 Allowed Glycine 0 N--CA 1.496 2.655 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.531 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.0 m -157.19 116.68 3.39 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.86 136.39 57.96 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.407 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.61 103.9 13.3 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -51.1 126.96 17.83 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.198 0.999 . . . . 0.0 109.641 -177.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -34.56 5.42 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.172 -2.771 . . . . 0.0 106.172 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.73 -35.47 7.36 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 178.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.423 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.3 mm-40 55.08 56.22 6.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 122.742 1.258 . . . . 0.0 110.025 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -141.02 125.02 10.31 Favored Pre-proline 0 C--N 1.293 -1.856 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -44.24 137.65 7.5 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 120.372 1.169 . . . . 0.0 114.993 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.531 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.8 mt -96.58 98.72 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.007 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 71.8 p -99.84 93.41 5.78 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.234 -0.916 . . . . 0.0 111.356 -177.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 153.25 -95.4 0.15 Allowed Glycine 0 N--CA 1.487 2.082 0 N-CA-C 107.406 -2.278 . . . . 0.0 107.406 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.477 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.29 152.48 31.3 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.1 p -144.48 126.19 15.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.012 -1.055 . . . . 0.0 111.265 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.8 mt -90.6 146.5 6.12 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.702 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.8 m -118.51 146.74 44.3 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 121.888 0.852 . . . . 0.0 109.049 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.761 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.85 -129.0 0.25 Allowed 'General case' 0 C--N 1.295 -1.79 0 CA-C-O 121.607 0.718 . . . . 0.0 109.407 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 14.1 mtp -65.57 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.761 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.02 -8.75 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -178.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -81.84 159.93 23.62 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt -102.91 174.47 5.86 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.69 136.18 8.01 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.231 -1.388 . . . . 0.0 109.957 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.588 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.79 115.81 10.52 Favored Pre-proline 0 C--N 1.3 -1.567 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 177.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.7 Cg_exo -46.22 -8.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.452 0 CA-C-N 120.353 1.162 . . . . 0.0 111.814 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.588 ' N ' ' O ' ' B' ' 569' ' ' HIS . 12.2 mt-10 -100.64 -52.84 3.23 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.021 0.915 . . . . 0.0 110.06 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.474 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.2 m170 -57.03 -4.7 0.19 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.848 -1.157 . . . . 0.0 109.863 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.516 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.6 t80 -124.77 54.53 1.4 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 178.198 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . 0.424 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 15.7 m -93.74 177.6 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.827 0.823 . . . . 0.0 110.738 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.467 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -76.9 149.33 36.07 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -96.35 76.07 2.95 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 116.787 -1.965 . . . . 0.0 110.736 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.84 -56.97 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 172.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.8 p -117.21 121.99 42.74 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 112.535 -2.121 . . . . 0.0 106.772 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 10.8 mp -75.01 14.19 0.56 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 121.05 -1.031 . . . . 0.0 111.981 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.27 -39.5 11.48 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 119.361 -2.087 . . . . 0.0 115.277 -175.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -162.72 141.57 8.79 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 122.513 2.415 . . . . 0.0 116.332 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.467 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 19.7 tp -142.04 168.69 19.15 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 174.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.504 ' O ' ' N ' ' B' ' 587' ' ' PHE . 72.2 m-20 -149.82 135.86 18.76 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.917 -1.114 . . . . 0.0 109.048 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.702 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 1.2 ptpp? -54.87 -14.37 1.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.21 -0.931 . . . . 0.0 109.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . 0.41 ' H ' ' C ' ' B' ' 583' ' ' ASN . . . -94.72 -15.5 45.93 Favored Glycine 0 N--CA 1.486 2.019 0 N-CA-C 108.735 -1.746 . . . . 0.0 108.735 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.1 p -136.72 26.17 3.07 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.907 -0.76 . . . . 0.0 108.983 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 2.2 p90 -89.25 108.18 19.47 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 122.446 1.117 . . . . 0.0 109.338 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.56 165.63 11.53 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.429 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -153.2 157.29 40.02 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 122.656 1.217 . . . . 0.0 110.718 -178.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.507 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -156.56 145.96 20.62 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.592 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 46.79 23.58 0.27 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.037 -1.039 . . . . 0.0 109.497 -179.642 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.48 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 82.55 -7.19 1.29 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.818 -0.551 . . . . 0.0 110.865 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -87.83 116.45 66.2 Favored Pre-proline 0 C--N 1.295 -1.763 0 O-C-N 121.123 -0.986 . . . . 0.0 110.067 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.3 Cg_exo -50.26 164.34 0.49 Allowed 'Trans proline' 0 N--CA 1.488 1.176 0 CA-C-N 120.026 1.045 . . . . 0.0 111.698 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 24.2 m-85 -170.4 140.5 1.83 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.259 -0.901 . . . . 0.0 109.837 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.7 m -69.63 154.72 41.59 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 175.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.422 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.7 -56.97 15.34 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 178.481 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.31 -30.04 1.9 Allowed 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 6.6 m -81.24 -63.14 1.46 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.554 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.48 -54.34 28.07 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.437 0.637 . . . . 0.0 110.375 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.554 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -52.78 -41.8 64.44 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.375 -0.828 . . . . 0.0 109.902 -178.07 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.83 -23.22 66.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.031 -1.043 . . . . 0.0 110.719 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.86 -56.3 3.14 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.571 -1.331 . . . . 0.0 111.915 -177.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.449 ' C ' ' SG ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -103.7 4.77 35.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.185 -0.947 . . . . 0.0 111.155 -177.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.449 ' SG ' ' C ' ' B' ' 604' ' ' PHE . 2.1 m . . . . . 0 N--CA 1.498 1.95 0 O-C-N 120.714 -1.241 . . . . 0.0 109.445 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttm . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.84 -43.99 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.103 -0.998 . . . . 0.0 108.774 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.603 ' CD1' ' H ' ' A' ' 3' ' ' LEU . 5.6 mp -58.85 -66.47 0.49 Allowed 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 122.175 0.988 . . . . 0.0 109.111 179.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -74.49 18.66 0.15 Allowed 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.54 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -59.72 -15.87 35.67 Favored Glycine 0 N--CA 1.488 2.103 0 N-CA-C 108.016 -2.034 . . . . 0.0 108.016 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.523 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -106.85 -98.64 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -179.13 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.577 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -152.69 -99.34 0.05 Allowed 'General case' 0 N--CA 1.486 1.342 0 O-C-N 120.816 -1.177 . . . . 0.0 109.872 -179.626 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.577 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -145.5 -62.13 0.02 OUTLIER Pre-proline 0 N--CA 1.5 2.069 0 O-C-N 120.948 -1.095 . . . . 0.0 110.763 -179.111 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -43.28 -33.81 4.13 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 CA-C-N 121.017 1.399 . . . . 0.0 110.24 178.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -116.57 -27.05 6.84 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.534 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.45 5.4 68.54 Favored Glycine 0 N--CA 1.486 2.013 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.492 ' C ' ' H ' ' A' ' 14' ' ' ALA . 9.7 t -172.26 -55.19 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.356 -1.085 . . . . 0.0 110.154 -179.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.53 ' O ' ' CB ' ' A' ' 14' ' ' ALA . 1.5 t80 78.21 -45.44 0.41 Allowed 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 -178.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.53 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 151.99 -27.62 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -174.79 -21.71 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 112.86 14.46 10.15 Favored Glycine 0 N--CA 1.499 2.838 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.541 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.1 OUTLIER -98.61 126.84 44.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.383 -1.069 . . . . 0.0 109.839 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.5 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.5 OUTLIER -128.58 123.86 34.46 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.296 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.518 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.83 137.75 39.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.903 . . . . 0.0 109.561 -179.465 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.23 129.17 34.86 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.06 143.29 37.55 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.882 -1.136 . . . . 0.0 108.353 179.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.47 153.24 30.61 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-O 121.65 0.738 . . . . 0.0 109.415 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.421 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 24.5 m80 -123.26 102.16 7.78 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.005 -1.479 . . . . 0.0 107.005 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.96 102.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.536 ' C ' ' H ' ' A' ' 27' ' ' LEU . 53.9 p -75.72 -35.39 60.26 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.34 -0.85 . . . . 0.0 109.675 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -76.01 19.05 0.24 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.181 -0.95 . . . . 0.0 108.496 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.536 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -154.74 -28.51 0.11 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.627 -0.671 . . . . 0.0 109.203 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.2 OUTLIER 82.97 12.64 0.46 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 122.135 -0.353 . . . . 0.0 110.199 -179.534 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -95.27 -178.32 4.41 Favored 'General case' 0 C--N 1.309 -1.181 0 O-C-N 120.85 -1.157 . . . . 0.0 109.881 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.421 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 1.3 m-20 -138.44 121.04 16.22 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.257 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.7 t -119.46 154.58 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.788 0.804 . . . . 0.0 110.577 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.8 128.89 41.62 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -115.1 115.31 26.58 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.39 0.614 . . . . 0.0 110.034 -178.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.541 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.7 tpt180 -59.62 112.29 1.74 Allowed 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -140.73 -171.21 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.983 0.897 . . . . 0.0 110.461 -179.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 p -144.43 176.22 9.54 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.85 44.57 3.14 Favored Glycine 0 N--CA 1.481 1.681 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -145.61 1.68 0.92 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.589 -0.948 . . . . 0.0 108.881 178.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 m -89.14 134.0 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.939 -1.101 . . . . 0.0 109.547 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.516 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.8 m-70 -73.45 147.37 44.22 Favored 'General case' 0 C--N 1.29 -2.001 0 O-C-N 120.948 -1.095 . . . . 0.0 108.175 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.453 ' C ' ' H ' ' A' ' 43' ' ' GLY . 81.6 mt -48.75 -51.39 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 120.998 -1.064 . . . . 0.0 108.947 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.52 -10.87 6.42 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 108.482 -1.847 . . . . 0.0 108.482 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -74.93 -26.82 65.88 Favored Glycine 0 N--CA 1.483 1.773 0 N-CA-C 107.919 -2.073 . . . . 0.0 107.919 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 45' ' ' MET . 2.1 t -84.13 -42.95 17.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.404 ' C ' ' O ' ' A' ' 44' ' ' VAL . 40.9 mtm -45.51 -36.25 4.4 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.26 -65.81 0.73 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 121.398 0.618 . . . . 0.0 110.095 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.4 ' O ' ' C ' ' A' ' 48' ' ' LEU . 48.2 mttm -52.88 -55.67 21.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.446 -0.783 . . . . 0.0 111.275 -178.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -45.05 -56.69 4.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.946 -1.097 . . . . 0.0 109.759 -178.524 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.5 t -60.64 -47.36 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.04 -1.037 . . . . 0.0 110.117 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.446 ' CD ' ' HZ1' ' B' ' 593' ' ' LYS . 65.1 mm-40 -45.06 -39.63 5.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.153 -0.967 . . . . 0.0 109.85 -179.301 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -65.52 -57.06 9.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.318 -0.864 . . . . 0.0 110.392 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -67.17 0.45 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t0 62.62 89.03 0.09 Allowed 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.863 0.839 . . . . 0.0 109.242 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.576 ' O ' ' N ' ' A' ' 56' ' ' LYS . 1.6 p -155.67 33.13 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.303 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 tptt 41.23 17.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.778 -0.576 . . . . 0.0 110.649 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.576 ' N ' ' O ' ' A' ' 54' ' ' VAL . 16.7 ttmm -78.7 146.72 33.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.967 -1.083 . . . . 0.0 109.027 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.53 115.09 2.12 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.509 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 60.4 m95 -117.72 -33.66 4.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.609 -0.682 . . . . 0.0 109.905 -179.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.5 t -42.99 -55.78 3.62 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.433 -0.792 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -50.99 -43.65 60.76 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.211 -0.93 . . . . 0.0 108.521 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.413 ' HD1' ' H ' ' A' ' 61' ' ' HIS . 8.5 m80 -72.45 134.17 45.21 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.732 0.777 . . . . 0.0 110.214 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.86 -179.31 6.51 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.564 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -95.12 137.73 33.77 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.812 -1.18 . . . . 0.0 110.682 -179.384 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.474 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -125.88 148.97 49.03 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.55 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -105.13 92.08 4.07 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.711 -1.243 . . . . 0.0 108.708 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -54.31 -23.57 15.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.255 -0.903 . . . . 0.0 110.734 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.497 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 23.7 mmtp -67.82 -10.56 53.95 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -134.0 -11.43 2.6 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.132 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.55 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.63 45.84 27.86 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -111.93 -171.05 1.77 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.322 0.582 . . . . 0.0 109.804 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.551 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.56 99.68 5.46 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 177.608 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 36.1 mt -60.07 88.47 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.69 1.233 . . . . 0.0 110.634 -176.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.476 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.0 pp -123.04 13.04 9.71 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 178.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.525 ' C ' ' H ' ' A' ' 76' ' ' HIS . 10.1 mmpt? -75.37 43.18 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.735 -0.603 . . . . 0.0 109.966 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.7 m -54.75 -6.37 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.982 -1.074 . . . . 0.0 109.58 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.525 ' H ' ' C ' ' A' ' 74' ' ' LYS . 87.2 m-70 -55.97 -68.57 0.19 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.252 -0.905 . . . . 0.0 110.861 -179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -99.05 -115.86 0.15 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.137 -0.977 . . . . 0.0 110.636 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.41 155.44 36.37 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 -178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.543 ' O ' ' N ' ' A' ' 82' ' ' TYR . 1.2 pt? -43.8 -51.1 7.58 Favored 'General case' 0 C--N 1.295 -1.78 0 O-C-N 121.275 -0.89 . . . . 0.0 110.654 179.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.454 ' H ' HD21 ' A' ' 79' ' ' LEU . 17.6 t70 -45.49 -32.25 2.13 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.213 -0.929 . . . . 0.0 109.852 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.525 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -72.55 -32.01 65.72 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 -179.623 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.543 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.5 OUTLIER -73.33 -49.55 26.79 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 124.28 4.55 7.64 Favored Glycine 0 N--CA 1.51 3.619 0 N-CA-C 108.65 -1.78 . . . . 0.0 108.65 179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.9 mt -60.08 162.29 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -156.22 -164.64 1.73 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.048 -1.033 . . . . 0.0 108.741 178.697 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.57 -21.27 60.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.175 -0.953 . . . . 0.0 109.833 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.1 3.24 43.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.335 -0.853 . . . . 0.0 109.402 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.98 113.61 25.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.355 -0.841 . . . . 0.0 109.315 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -97.39 125.77 42.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.059 -1.026 . . . . 0.0 109.228 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.6 mt -112.7 178.61 4.23 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.714 0.769 . . . . 0.0 109.388 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.474 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.2 mt-30 -129.9 168.19 17.01 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -123.73 90.88 3.35 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.53 169.26 9.81 Favored Pre-proline 0 N--CA 1.5 2.061 0 O-C-N 121.737 -0.602 . . . . 0.0 110.332 -176.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo . . . . . 0 N--CA 1.493 1.494 0 C-N-CA 123.193 2.595 . . . . 0.0 112.643 179.0 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . 0.432 ' N ' ' HD1' ' B' ' 542' ' ' HIS . 1.4 m-70 -53.11 -79.97 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.141 -0.974 . . . . 0.0 109.276 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.466 ' CG ' ' H ' ' B' ' 544' ' ' ARG . 0.7 OUTLIER -134.05 -98.89 0.26 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.149 -0.969 . . . . 0.0 108.957 179.711 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.466 ' H ' ' CG ' ' B' ' 543' ' ' GLU . 10.4 mpt_? -82.8 -93.82 0.06 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.249 -0.907 . . . . 0.0 111.062 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.529 ' NH1' ' O ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -87.6 -106.02 0.07 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.126 -0.984 . . . . 0.0 110.614 -178.123 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . 0.529 ' O ' ' NH1' ' B' ' 545' ' ' ARG . . . 162.29 -94.83 0.13 Allowed Glycine 0 N--CA 1.492 2.429 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 -179.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.543 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.1 m -152.35 113.78 4.29 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 179.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.18 137.13 58.24 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.23 -0.919 . . . . 0.0 110.653 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.86 103.84 13.46 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 178.197 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.5 t -49.62 125.99 12.66 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.086 0.946 . . . . 0.0 109.624 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.33 -34.95 5.2 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 106.444 -2.663 . . . . 0.0 106.444 -177.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.17 -35.29 7.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.6 mm-40 55.01 56.27 6.77 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 122.694 1.235 . . . . 0.0 109.899 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt -140.83 124.7 10.34 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -43.7 138.29 5.8 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 CA-C-N 120.428 1.189 . . . . 0.0 114.83 -178.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.543 ' N ' ' O ' ' B' ' 547' ' ' SER . 41.6 mt -97.61 98.69 7.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 51.8 p -100.06 91.35 4.74 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 121.955 0.883 . . . . 0.0 111.234 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.41 -96.66 0.16 Allowed Glycine 0 N--CA 1.488 2.102 0 N-CA-C 107.349 -2.3 . . . . 0.0 107.349 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.484 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 6.0 mmt-85 -113.08 153.02 28.84 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.5 p -144.83 126.47 15.13 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.022 -1.049 . . . . 0.0 111.425 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.4 mt -90.61 146.15 6.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 10.9 m -121.5 146.61 46.75 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.0 0.905 . . . . 0.0 109.151 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.724 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -128.92 0.26 Allowed 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.9 mtp -65.75 25.88 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.724 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.0 -8.56 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.84 149.07 28.5 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.5 mmmt -96.02 174.72 6.78 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.43 134.67 7.3 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.436 -1.306 . . . . 0.0 109.939 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.581 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.2 m80 -55.42 114.8 7.87 Favored Pre-proline 0 C--N 1.303 -1.428 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 177.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.577 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.1 Cg_exo -45.67 -10.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 CA-C-N 120.306 1.145 . . . . 0.0 111.964 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.581 ' N ' ' O ' ' B' ' 569' ' ' HIS . 5.9 mt-10 -100.64 -53.01 3.19 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 122.052 0.93 . . . . 0.0 110.067 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.499 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.7 m170 -55.41 -5.92 0.15 Allowed 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.589 -1.319 . . . . 0.0 109.839 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.509 ' H ' ' C ' ' B' ' 571' ' ' GLU . 21.2 t80 -124.27 52.53 1.49 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 11.4 m -93.47 176.89 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 CA-C-O 121.514 0.673 . . . . 0.0 110.125 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.453 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.44 144.03 38.12 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 107.597 -1.261 . . . . 0.0 107.597 179.029 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -90.89 74.09 6.49 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 116.258 -2.177 . . . . 0.0 109.488 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -153.99 -65.85 0.14 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 172.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.528 ' O ' ' N ' ' B' ' 580' ' ' LYS . 17.0 p -110.67 84.03 1.86 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 112.514 -2.13 . . . . 0.0 105.616 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . 0.627 ' CD1' ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.49 15.1 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.528 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.67 -38.7 15.64 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 119.542 -1.973 . . . . 0.0 112.542 -178.267 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.577 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.25 142.16 9.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 119.5 -2.0 . . . . 0.0 115.02 178.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.453 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.7 tp -136.7 170.1 16.63 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 175.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.502 ' O ' ' N ' ' B' ' 587' ' ' PHE . 77.2 m-20 -145.2 129.26 17.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.066 -1.022 . . . . 0.0 109.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -50.84 -22.64 2.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.522 -0.736 . . . . 0.0 109.651 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.12 -18.1 59.89 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.004 -1.638 . . . . 0.0 109.004 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 586' ' ' THR . . . . . 0.436 ' N ' ' O ' ' B' ' 583' ' ' ASN . 2.9 p -133.12 26.31 4.22 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.568 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.3 OUTLIER -89.48 108.53 19.7 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.579 1.18 . . . . 0.0 109.974 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.44 168.4 10.01 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.411 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.46 157.15 40.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.747 -1.221 . . . . 0.0 110.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.532 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.6 tp60 -150.84 144.2 24.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.553 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 41.98 27.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.217 -0.927 . . . . 0.0 110.452 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 3.6 m-20 84.26 -8.37 0.98 Allowed 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.758 -0.588 . . . . 0.0 111.05 179.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . 0.446 ' HZ1' ' CD ' ' A' ' 50' ' ' GLU . 53.2 mttt -88.18 116.78 67.26 Favored Pre-proline 0 C--N 1.296 -1.732 0 O-C-N 121.162 -0.961 . . . . 0.0 109.973 -179.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.2 Cg_exo -50.2 163.93 0.54 Allowed 'Trans proline' 0 N--CA 1.492 1.434 0 CA-C-N 119.887 0.995 . . . . 0.0 112.576 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.526 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 21.6 m-85 -170.84 139.65 1.51 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.404 -0.81 . . . . 0.0 109.589 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 10.0 m -68.5 157.23 36.4 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 175.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.438 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.2 -55.58 32.05 Favored 'General case' 0 C--N 1.294 -1.836 0 C-N-CA 117.253 -1.779 . . . . 0.0 106.56 179.203 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.5 -31.28 2.64 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.331 -0.856 . . . . 0.0 109.182 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.28 -56.52 4.15 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.456 ' CD2' ' OE1' ' B' ' 590' ' ' GLN . 2.4 t80 -60.32 -53.53 56.56 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.443 0.64 . . . . 0.0 110.498 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.45 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.45 -43.34 62.06 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.117 -0.989 . . . . 0.0 109.431 -178.348 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.82 -20.43 50.36 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.994 -1.066 . . . . 0.0 110.163 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 1.2 mt -91.98 -56.93 2.89 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.651 -1.28 . . . . 0.0 110.331 -178.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' C ' ' B' ' 605' ' ' CYS . 24.5 m-85 -106.41 32.36 4.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.508 -0.745 . . . . 0.0 109.935 -179.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' B' ' 604' ' ' PHE . 3.9 t . . . . . 0 N--CA 1.502 2.145 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.759 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 mtm . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 122.455 1.122 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -158.87 -45.56 0.06 Allowed 'General case' 0 C--N 1.293 -1.878 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.025 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.592 ' O ' ' CG ' ' A' ' 4' ' ' ASP . 25.9 mt -51.81 -69.57 0.11 Allowed 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.545 -0.722 . . . . 0.0 109.951 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.592 ' CG ' ' O ' ' A' ' 3' ' ' LEU . 2.6 p30 63.08 -44.26 0.21 Allowed 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.656 -177.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.496 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 110.05 -15.56 30.8 Favored Glycine 0 N--CA 1.494 2.501 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.533 ' N ' ' OD2' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -114.22 -106.89 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.247 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.536 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -156.05 -96.81 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.336 -1.477 . . . . 0.0 110.227 -179.671 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.57 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -131.83 -53.62 0.03 OUTLIER Pre-proline 0 N--CA 1.508 2.458 0 O-C-N 120.924 -1.11 . . . . 0.0 111.554 -179.05 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -58.31 -36.3 97.81 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 CA-C-N 121.079 1.421 . . . . 0.0 110.216 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -107.24 -25.92 11.28 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.11 -7.11 83.89 Favored Glycine 0 N--CA 1.487 2.039 0 N-CA-C 108.861 -1.696 . . . . 0.0 108.861 179.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.594 ' SG ' ' N ' ' A' ' 13' ' ' TYR . 12.4 t -159.38 -103.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.595 -0.944 . . . . 0.0 109.166 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.594 ' N ' ' SG ' ' A' ' 12' ' ' CYS . 42.1 m-85 -164.92 -112.95 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.302 -0.874 . . . . 0.0 108.997 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -176.6 -38.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.185 -0.947 . . . . 0.0 109.39 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -144.89 1.33 0.99 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.357 -0.84 . . . . 0.0 109.708 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.22 36.42 45.48 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.534 ' OG1' ' N ' ' A' ' 18' ' ' TRP . 2.7 t -167.85 178.46 5.2 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 117.548 -1.661 . . . . 0.0 111.693 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.534 ' N ' ' OG1' ' A' ' 17' ' ' THR . 0.5 OUTLIER -165.48 127.87 2.09 Favored 'General case' 0 C--N 1.277 -2.552 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.673 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.516 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -83.78 132.21 34.85 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.961 -1.087 . . . . 0.0 109.521 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.488 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.86 133.51 34.73 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.174 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.15 145.73 35.49 Favored 'General case' 0 C--N 1.295 -1.797 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.176 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -137.35 114.11 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.7 0.762 . . . . 0.0 110.015 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -85.76 103.77 14.84 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.538 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.63 107.01 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.577 ' C ' ' H ' ' A' ' 27' ' ' LEU . 41.5 p -78.2 -41.08 35.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.327 -0.858 . . . . 0.0 110.037 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -73.02 20.53 0.08 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.055 -1.028 . . . . 0.0 108.793 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.7 mt -154.49 -33.0 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.538 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 85.23 14.09 0.19 Allowed 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 120.707 0.289 . . . . 0.0 110.429 -179.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.0 mtp-105 -95.58 -178.27 4.35 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 120.911 -1.118 . . . . 0.0 110.036 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -135.86 116.98 14.39 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.1 t -115.36 155.13 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.681 0.753 . . . . 0.0 110.004 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.37 131.59 38.45 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -118.54 115.91 25.57 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.451 ' CD ' ' C ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -61.6 133.85 56.13 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.459 ' O ' ' OG1' ' A' ' 17' ' ' THR . 13.9 m -160.7 -170.22 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.019 0 CA-C-O 122.071 0.938 . . . . 0.0 110.012 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 38' ' ' GLU . 0.8 OUTLIER -142.13 171.16 14.43 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.047 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -77.58 45.04 2.33 Favored Glycine 0 C--N 1.293 -1.831 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.447 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.7 OUTLIER -144.99 3.49 1.06 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.765 -0.844 . . . . 0.0 108.926 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.414 HG11 ' H ' ' A' ' 36' ' ' THR . 2.6 m -90.1 135.69 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.041 -1.037 . . . . 0.0 110.076 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.515 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.8 OUTLIER -72.5 142.46 48.54 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 120.944 -1.098 . . . . 0.0 108.217 178.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.513 ' C ' ' H ' ' A' ' 43' ' ' GLY . 94.1 mt -47.8 -55.54 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.051 -1.031 . . . . 0.0 109.268 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.413 ' H ' ' CG2' ' A' ' 75' ' ' THR . . . -55.8 -8.9 2.32 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.531 -1.828 . . . . 0.0 108.531 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -75.12 -28.25 62.62 Favored Glycine 0 N--CA 1.484 1.869 0 N-CA-C 107.585 -2.206 . . . . 0.0 107.585 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.29 -40.88 16.53 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.1 mtm -47.64 -35.02 8.73 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.57 -65.72 0.79 Allowed 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.745 -0.597 . . . . 0.0 109.954 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 53.5 mttm -49.39 -59.85 3.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.372 -0.83 . . . . 0.0 110.8 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.51 -55.56 6.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.016 -1.052 . . . . 0.0 109.39 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 70.0 t -56.5 -48.76 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -46.72 -40.71 13.87 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.053 -1.03 . . . . 0.0 109.591 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -76.6 -36.83 57.26 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.411 -0.805 . . . . 0.0 110.853 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -65.01 0.75 Allowed 'General case' 0 C--N 1.305 -1.342 0 O-C-N 120.914 -1.116 . . . . 0.0 108.904 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 67.16 79.25 0.23 Allowed 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 121.822 0.82 . . . . 0.0 109.816 179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.6 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.7 p -171.03 146.06 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 C-N-CA 119.696 -0.802 . . . . 0.0 110.005 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.28 34.91 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.315 -0.866 . . . . 0.0 108.931 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.6 ' H ' ' C ' ' A' ' 54' ' ' VAL . 16.0 ttmm -77.74 161.49 27.67 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.127 -0.983 . . . . 0.0 108.873 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -77.13 90.64 3.66 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 109.027 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.464 ' O ' ' O ' ' A' ' 61' ' ' HIS . 11.1 m0 -72.8 -58.15 3.56 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.344 -0.848 . . . . 0.0 109.106 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.5 t -42.25 -56.87 2.76 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.288 0.565 . . . . 0.0 110.463 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -53.87 -45.99 71.16 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 58' ' ' TRP . 51.6 m170 -72.94 121.03 19.4 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.794 0.807 . . . . 0.0 110.127 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -134.45 177.96 7.36 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.57 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.45 140.47 29.78 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.894 -1.129 . . . . 0.0 109.705 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.488 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.49 151.37 48.93 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.35 94.08 4.84 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.064 -1.022 . . . . 0.0 108.659 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.431 ' OE2' ' OE1' ' A' ' 91' ' ' GLN . 10.6 pt-20 -55.4 -23.42 24.61 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.327 -0.858 . . . . 0.0 110.886 -179.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.508 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.9 mmtp -69.34 -9.32 52.83 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -133.63 -11.81 2.7 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.068 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.6 45.54 28.43 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -112.36 -172.32 2.02 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.441 0.639 . . . . 0.0 109.798 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.535 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.79 99.65 5.63 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 177.391 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.1 mt -59.88 84.93 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.667 1.222 . . . . 0.0 110.73 -176.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -121.92 10.39 10.17 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.534 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -84.66 33.47 0.52 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.413 ' CG2' ' H ' ' A' ' 42' ' ' GLY . 24.0 m -49.63 -10.01 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 0.0 109.579 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.534 ' H ' ' C ' ' A' ' 74' ' ' LYS . 12.8 m80 -55.61 -15.05 2.5 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.187 -0.945 . . . . 0.0 109.89 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -138.07 -122.25 0.13 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.227 -0.921 . . . . 0.0 109.413 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.42 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -151.96 -164.53 2.0 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.15 -1.594 . . . . 0.0 111.11 -178.374 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.542 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.3 mp -71.53 -56.0 6.75 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -43.15 -48.52 6.38 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.667 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -57.15 -30.41 64.42 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.931 -178.59 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.481 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -88.76 -44.7 10.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.135 -0.978 . . . . 0.0 108.575 179.712 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 111.23 27.24 4.29 Favored Glycine 0 N--CA 1.501 3.005 0 N-CA-C 108.515 -1.834 . . . . 0.0 108.515 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.538 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 38.8 mt -82.61 160.96 3.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.788 -0.83 . . . . 0.0 109.614 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -166.65 -173.3 2.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.439 -0.788 . . . . 0.0 108.894 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.48 -22.65 67.03 Favored 'General case' 0 C--N 1.298 -1.673 0 O-C-N 121.466 -0.771 . . . . 0.0 110.137 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.26 -8.84 59.35 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.098 -179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.488 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.04 113.73 26.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.562 -0.711 . . . . 0.0 109.099 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -94.43 117.33 29.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.974 -1.079 . . . . 0.0 109.527 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.9 mt -95.7 176.89 5.98 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.484 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.9 mt-30 -131.88 168.13 18.39 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -122.38 91.9 3.6 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.3 171.65 7.2 Favored Pre-proline 0 N--CA 1.501 2.091 0 O-C-N 121.65 -0.656 . . . . 0.0 109.834 -177.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo . . . . . 0 N--CA 1.493 1.461 0 C-N-CA 122.753 2.302 . . . . 0.0 112.453 179.305 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 22.5 t80 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . 0.575 ' CG ' ' H ' ' B' ' 543' ' ' GLU . 17.1 t60 -130.18 -130.7 0.21 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.521 -0.737 . . . . 0.0 109.188 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.575 ' H ' ' CG ' ' B' ' 542' ' ' HIS . 9.6 tt0 64.86 105.37 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 122.481 1.134 . . . . 0.0 109.835 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.523 ' O ' ' C ' ' B' ' 545' ' ' ARG . 21.1 mmt180 -43.7 167.31 0.01 OUTLIER 'General case' 0 C--N 1.288 -2.084 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.752 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.523 ' C ' ' O ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER -6.77 -112.87 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -179.802 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -99.97 -108.23 2.95 Favored Glycine 0 N--CA 1.496 2.667 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -175.68 120.74 0.18 Allowed 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -57.28 135.18 56.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.742 -1.224 . . . . 0.0 110.523 -178.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.97 103.99 13.67 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.0 t -49.46 125.86 12.09 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 122.045 0.926 . . . . 0.0 109.786 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.27 -34.77 5.31 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 106.406 -2.678 . . . . 0.0 106.406 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -105.12 -35.75 7.51 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.21 56.45 6.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.736 1.255 . . . . 0.0 109.826 -178.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -140.63 123.89 10.14 Favored Pre-proline 0 C--N 1.294 -1.826 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 177.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -43.84 134.42 7.84 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 CA-C-N 120.429 1.189 . . . . 0.0 114.825 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.54 ' N ' ' O ' ' B' ' 547' ' ' SER . 41.5 mt -93.02 99.99 10.58 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 67.1 p -101.45 93.14 5.24 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.241 -0.912 . . . . 0.0 111.22 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.5 -94.35 0.14 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.323 -2.311 . . . . 0.0 107.323 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.471 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -115.88 152.47 33.33 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.78 126.9 15.61 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.981 -1.074 . . . . 0.0 111.5 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 49.6 mt -91.02 146.27 6.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.628 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 9.3 m -121.03 146.25 46.91 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.939 0.876 . . . . 0.0 109.091 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.722 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.83 -128.87 0.26 Allowed 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 5.9 mtp -65.89 26.09 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.569 -0.707 . . . . 0.0 109.11 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.722 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.28 -8.97 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 148.53 27.89 Favored 'General case' 0 C--N 1.306 -1.298 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -94.65 174.8 6.93 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.64 134.96 7.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.442 -1.303 . . . . 0.0 109.929 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.4 m80 -55.91 115.33 9.36 Favored Pre-proline 0 C--N 1.302 -1.473 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.578 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 44.3 Cg_exo -45.75 -11.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.317 1.149 . . . . 0.0 111.586 -178.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' B' ' 569' ' ' HIS . 11.2 mt-10 -98.3 -52.87 3.52 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 122.102 0.953 . . . . 0.0 110.077 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.48 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.1 m170 -57.04 -4.58 0.19 Allowed 'General case' 0 C--N 1.292 -1.901 0 O-C-N 120.633 -1.292 . . . . 0.0 109.715 -179.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.511 ' H ' ' C ' ' B' ' 571' ' ' GLU . 14.0 t80 -127.55 54.43 1.68 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 13.8 m -93.53 177.58 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 121.624 0.726 . . . . 0.0 110.147 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.442 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.88 141.42 32.24 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.369 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . 0.488 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.52 76.41 6.6 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 116.719 -1.992 . . . . 0.0 108.801 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -153.1 -61.52 0.15 Allowed 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 102.498 -3.149 . . . . 0.0 102.498 174.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 20.8 p -120.16 81.57 1.76 Allowed 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 111.647 -2.524 . . . . 0.0 104.803 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.2 mt -53.02 15.48 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.53 -38.15 17.5 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 119.636 -1.915 . . . . 0.0 112.258 -178.547 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.578 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.8 tp60 -161.09 142.36 11.69 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 119.673 -1.892 . . . . 0.0 114.341 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.442 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 24.0 tp -134.06 171.02 14.79 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 74.0 m-20 -146.77 128.53 15.27 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.186 -0.947 . . . . 0.0 109.468 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.628 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.5 ptpp? -50.66 -19.41 0.92 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.622 -0.673 . . . . 0.0 110.014 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -85.51 -21.15 55.01 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.894 -1.683 . . . . 0.0 108.894 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -133.75 28.63 3.9 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.69 107.05 18.87 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 122.788 1.28 . . . . 0.0 110.288 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.531 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -100.88 168.46 9.62 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 12.0 tt0 -152.4 157.22 40.93 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.795 -1.191 . . . . 0.0 110.673 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.598 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 1.2 tp-100 -154.15 145.83 23.31 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.551 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 45.68 23.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.03 -1.044 . . . . 0.0 109.872 -179.719 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.77 -4.85 1.54 Allowed 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.386 0.612 . . . . 0.0 110.482 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -88.59 121.19 70.24 Favored Pre-proline 0 C--N 1.294 -1.825 0 O-C-N 121.306 -0.871 . . . . 0.0 109.394 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.44 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 49.7 Cg_exo -48.84 164.64 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.22 0 CA-C-N 120.106 1.073 . . . . 0.0 111.782 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.531 ' O ' ' N ' ' B' ' 588' ' ' LYS . 7.4 m-85 -170.75 142.08 1.91 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.024 -1.048 . . . . 0.0 110.373 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 22.4 m -77.8 154.78 31.57 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.467 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.58 -58.3 9.07 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 179.113 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -46.17 -26.64 0.81 Allowed 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.675 -0.64 . . . . 0.0 109.484 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.4 m -85.0 -63.9 1.25 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.544 -0.722 . . . . 0.0 109.099 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -52.49 -53.85 40.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.519 -0.738 . . . . 0.0 109.355 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.619 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -49.59 -42.33 44.33 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.52 -24.73 14.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.364 -0.835 . . . . 0.0 109.559 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.8 mt -93.76 -57.21 2.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.251 -0.906 . . . . 0.0 111.685 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.598 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.6 m-85 -87.16 31.5 0.72 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.046 -1.034 . . . . 0.0 110.253 -178.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.943 -1.098 . . . . 0.0 109.447 179.253 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ttt . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 3' ' ' LEU . . . -151.27 -20.65 0.2 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.999 -1.063 . . . . 0.0 109.232 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' A' ' 5' ' ' GLY . 48.5 mt -38.63 -72.45 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 122.449 1.118 . . . . 0.0 109.801 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' CG ' ' O ' ' A' ' 4' ' ' ASP . 21.8 t70 45.26 19.26 0.04 OUTLIER 'General case' 0 C--N 1.289 -2.023 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.585 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 3' ' ' LEU . . . -66.74 -10.61 55.5 Favored Glycine 0 N--CA 1.486 2.018 0 N-CA-C 108.21 -1.956 . . . . 0.0 108.21 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.471 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -108.33 -105.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.962 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.537 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -156.38 -96.85 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 O-C-N 120.376 -1.453 . . . . 0.0 110.597 -179.598 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.537 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -133.29 -53.48 0.03 OUTLIER Pre-proline 0 N--CA 1.509 2.522 0 O-C-N 120.882 -1.136 . . . . 0.0 112.065 -178.673 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -56.71 -34.9 97.12 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 CA-C-N 120.815 1.327 . . . . 0.0 110.094 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -111.43 -26.2 9.22 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.94 -3.02 88.18 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 8' ' ' MET . 0.7 OUTLIER -156.6 -28.85 0.09 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.94 -1.329 . . . . 0.0 110.371 -179.438 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.503 ' O ' ' CB ' ' A' ' 14' ' ' ALA . 84.1 m-85 58.88 -94.41 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.503 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 164.49 -37.68 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.505 -0.747 . . . . 0.0 109.019 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -148.79 1.06 0.57 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.263 -0.898 . . . . 0.0 109.747 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 14.59 57.73 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.557 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -84.61 125.55 32.55 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.118 -1.225 . . . . 0.0 109.44 179.789 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.87 118.96 23.58 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.06 127.44 32.91 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.068 -1.053 . . . . 0.0 108.368 -179.769 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.463 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -82.82 134.02 35.12 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 179.568 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -76.78 145.66 38.38 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.414 ' N ' ' O ' ' A' ' 31' ' ' VAL . 14.3 t -137.57 105.85 3.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 CA-C-O 121.784 0.802 . . . . 0.0 110.036 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.499 ' NE2' ' OD1' ' A' ' 30' ' ' ASP . 23.7 m80 -82.5 103.53 12.11 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -73.72 120.18 22.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.511 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.3 p -80.35 -60.51 2.29 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.06 -1.025 . . . . 0.0 111.064 -177.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.435 ' N ' ' OG1' ' A' ' 25' ' ' THR . 14.0 t0 -50.04 -11.01 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.755 -1.215 . . . . 0.0 109.853 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.511 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.6 mt -119.13 -37.17 3.24 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 85.93 8.15 0.33 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 122.364 -0.21 . . . . 0.0 111.555 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -93.28 -175.75 3.92 Favored 'General case' 0 C--N 1.31 -1.112 0 O-C-N 120.487 -1.383 . . . . 0.0 109.236 179.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' NE2' ' A' ' 23' ' ' HIS . 20.6 m-20 -131.97 115.81 16.33 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.705 0.764 . . . . 0.0 109.125 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.414 ' O ' ' N ' ' A' ' 22' ' ' VAL . 35.7 t -109.21 157.2 9.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.5 131.84 40.31 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -113.8 113.08 24.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.617 -0.677 . . . . 0.0 109.291 -178.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.557 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 10.7 tpt180 -60.03 104.17 0.28 Allowed 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.28 -169.54 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 122.119 0.961 . . . . 0.0 110.89 -178.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.446 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.4 p -144.93 172.42 13.06 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.16 43.48 2.25 Favored Glycine 0 N--CA 1.483 1.804 0 N-CA-C 108.921 -1.672 . . . . 0.0 108.921 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.446 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.3 OUTLIER -142.39 3.61 1.53 Allowed 'General case' 0 N--CA 1.486 1.327 0 O-C-N 121.608 -0.936 . . . . 0.0 108.785 179.815 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.406 HG11 ' H ' ' A' ' 36' ' ' THR . 2.9 m -90.45 133.4 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.142 -0.974 . . . . 0.0 110.142 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.5 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.4 m-70 -76.24 144.2 40.51 Favored 'General case' 0 C--N 1.293 -1.867 0 O-C-N 120.814 -1.179 . . . . 0.0 108.579 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.457 ' C ' ' N ' ' A' ' 43' ' ' GLY . 82.5 mt -49.08 -51.53 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.992 -1.068 . . . . 0.0 109.101 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.55 -15.99 4.84 Favored Glycine 0 N--CA 1.484 1.847 0 N-CA-C 108.283 -1.927 . . . . 0.0 108.283 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.5 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -85.43 -25.85 38.06 Favored Glycine 0 N--CA 1.485 1.935 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 41' ' ' ILE . 38.5 t -81.44 -50.1 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.527 -0.984 . . . . 0.0 109.35 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -41.0 73.04 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.806 -1.184 . . . . 0.0 108.419 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tt -50.24 -58.56 5.34 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.239 -0.913 . . . . 0.0 109.174 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 48' ' ' LEU . 61.8 mttm -52.13 -54.54 29.36 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.468 -0.77 . . . . 0.0 110.561 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.417 ' C ' ' O ' ' A' ' 47' ' ' LYS . 4.0 mm? -45.67 -61.89 1.52 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.547 -1.346 . . . . 0.0 108.822 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 53' ' ' ASP . 97.4 t -52.69 -49.87 44.03 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 O-C-N 121.526 -0.733 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -46.3 -40.61 11.97 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.714 -1.241 . . . . 0.0 109.711 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -69.3 -57.63 5.06 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.322 -0.861 . . . . 0.0 110.325 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.2 tp -110.34 41.98 1.65 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.475 1.131 . . . . 0.0 109.56 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.626 ' N ' ' O ' ' A' ' 49' ' ' VAL . 36.4 t0 -52.08 -84.92 0.01 OUTLIER 'General case' 0 C--N 1.263 -3.186 0 CA-C-O 122.232 1.015 . . . . 0.0 109.291 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.534 ' O ' ' O ' ' A' ' 53' ' ' ASP . 14.1 p 43.14 179.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.277 -2.569 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.861 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.53 ' H ' ' CG2' ' A' ' 54' ' ' VAL . 0.7 OUTLIER -77.33 30.49 0.15 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.643 -1.286 . . . . 0.0 108.208 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.621 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 36.7 tttm -79.57 137.42 37.15 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.081 -1.048 . . . . 0.0 109.033 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -50.95 112.44 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.567 -0.708 . . . . 0.0 110.126 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.621 ' CH2' ' NZ ' ' A' ' 56' ' ' LYS . 12.7 m95 -127.44 -21.34 3.85 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.708 0.766 . . . . 0.0 109.788 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.2 t -40.05 -52.79 2.48 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.2 -0.938 . . . . 0.0 111.369 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.426 ' O ' ' O ' ' A' ' 94' ' ' PRO . 17.2 t0 -83.62 13.37 4.68 Favored 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.537 -0.727 . . . . 0.0 110.963 -178.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.62 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 3.6 p-80 -71.59 148.75 46.3 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 120.741 -1.224 . . . . 0.0 111.988 -178.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.98 155.22 5.5 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.558 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -93.93 148.46 22.13 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.532 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.25 151.52 48.61 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.333 -0.854 . . . . 0.0 108.913 -178.982 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -112.65 94.65 5.01 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.903 . . . . 0.0 108.639 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -55.77 -23.9 32.36 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.245 -0.909 . . . . 0.0 110.872 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.512 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -68.8 -9.03 48.69 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 178.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.56 -12.22 2.7 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.842 -178.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.1 mpp_? 52.43 45.77 27.91 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -113.37 -173.35 2.24 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.673 0.749 . . . . 0.0 110.143 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.32 101.64 7.06 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.721 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.435 ' N ' ' O ' ' A' ' 63' ' ' LEU . 34.4 mt -61.74 86.06 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.292 0 O-C-N 120.433 -1.417 . . . . 0.0 110.892 -176.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 8.74 11.39 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.541 ' C ' ' H ' ' A' ' 76' ' ' HIS . 9.5 mmpt? -74.93 58.53 0.85 Allowed 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.1 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.82 -5.95 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.692 ' HD1' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -36.03 -63.44 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.883 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -130.78 -100.04 0.31 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.222 -0.924 . . . . 0.0 111.221 -178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.427 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -151.35 -164.38 1.98 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 119.671 -1.893 . . . . 0.0 111.365 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.532 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.1 mp -68.8 -57.79 5.09 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -42.35 -46.7 4.7 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.456 ' HZ1' ' CB ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -62.23 -28.93 70.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.487 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -85.79 -47.4 9.76 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.418 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 113.59 21.71 5.68 Favored Glycine 0 N--CA 1.499 2.854 0 N-CA-C 108.088 -2.005 . . . . 0.0 108.088 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 36.4 mt -82.53 161.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.877 -0.778 . . . . 0.0 109.907 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -167.76 -163.4 0.49 Allowed 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.37 -27.12 62.18 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.435 -0.791 . . . . 0.0 109.598 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.71 -14.46 62.46 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.463 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.32 113.93 26.51 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -94.67 118.85 32.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.015 -1.053 . . . . 0.0 109.577 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.4 mt -96.0 176.94 5.92 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.714 0.768 . . . . 0.0 109.675 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.532 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 10.0 mt-30 -131.13 165.56 23.02 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 58' ' ' TRP . 31.8 t80 -133.8 90.92 2.76 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.66 153.74 39.71 Favored Pre-proline 0 N--CA 1.499 1.987 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.663 -178.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 60' ' ' ASP . 65.4 Cg_endo . . . . . 0 N--CA 1.493 1.479 0 C-N-CA 122.471 2.114 . . . . 0.0 111.444 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -98.95 -63.38 1.13 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.337 -0.852 . . . . 0.0 109.715 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.45 ' O ' ' O ' ' B' ' 544' ' ' ARG . 4.8 pt-20 -90.18 -0.4 57.59 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.258 -0.901 . . . . 0.0 110.041 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.495 ' N ' ' CD ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER 43.68 -169.39 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.309 -0.869 . . . . 0.0 110.305 179.534 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.475 ' N ' ' CD ' ' B' ' 545' ' ' ARG . 0.2 OUTLIER -69.02 -124.24 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.164 -0.96 . . . . 0.0 109.55 -179.805 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -168.12 -92.86 0.09 OUTLIER Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.849 -1.301 . . . . 0.0 109.849 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.552 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m -169.18 120.06 0.72 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.29 -1.124 . . . . 0.0 108.225 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.84 135.21 57.71 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 120.774 -1.204 . . . . 0.0 110.39 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.72 103.82 13.32 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 178.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -50.8 127.05 17.42 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-O 122.14 0.972 . . . . 0.0 109.601 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.68 -34.56 5.4 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 106.043 -2.823 . . . . 0.0 106.043 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -106.04 -35.71 7.17 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.03 56.31 6.73 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 122.663 1.22 . . . . 0.0 109.968 -178.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -140.72 124.17 10.18 Favored Pre-proline 0 C--N 1.293 -1.855 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.4 135.14 9.14 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.452 1.197 . . . . 0.0 114.583 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.552 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.8 mt -93.64 98.49 8.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.4 p -99.52 91.36 4.87 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.29 -0.881 . . . . 0.0 111.313 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.63 -95.31 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.455 -2.258 . . . . 0.0 107.455 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.478 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.28 151.66 32.55 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.56 126.3 15.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.964 -1.085 . . . . 0.0 111.556 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 46.8 mt -91.29 146.86 5.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.702 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.3 m -117.41 147.06 43.02 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-O 121.888 0.851 . . . . 0.0 109.336 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.737 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.29 -129.17 0.26 Allowed 'General case' 0 C--N 1.295 -1.789 0 CA-C-O 121.499 0.666 . . . . 0.0 109.383 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.73 26.13 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.737 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.19 -9.03 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.89 163.56 22.17 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -106.1 174.25 5.97 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.14 138.11 9.96 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.33 -1.348 . . . . 0.0 109.813 -179.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.596 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.4 m80 -57.16 116.24 12.98 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 177.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.565 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 52.7 Cg_exo -45.13 -10.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.461 0 CA-C-N 120.311 1.147 . . . . 0.0 111.894 -178.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.596 ' N ' ' O ' ' B' ' 569' ' ' HIS . 12.4 mt-10 -100.06 -52.42 3.42 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.018 0.913 . . . . 0.0 110.042 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.413 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.5 m170 -58.01 -4.25 0.31 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.864 -1.147 . . . . 0.0 109.81 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.495 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.1 t80 -125.91 54.66 1.5 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . 0.402 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 16.4 m -93.9 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 CA-C-O 121.925 0.869 . . . . 0.0 110.616 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.453 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.29 143.6 31.19 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.626 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.47 74.76 3.29 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 116.672 -2.011 . . . . 0.0 109.84 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . 0.593 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 0.3 OUTLIER -153.65 -48.31 0.09 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 102.047 -3.316 . . . . 0.0 102.047 173.244 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.544 ' SG ' ' O ' ' B' ' 578' ' ' CYS . 29.5 p -132.0 81.52 1.97 Allowed 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 176.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.8 mt -53.1 15.65 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.47 -37.38 18.34 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 119.686 -1.884 . . . . 0.0 112.628 -178.255 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.565 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -160.3 140.72 11.69 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 119.596 -1.94 . . . . 0.0 114.448 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.453 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.6 tp -137.77 169.82 17.13 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.5 m-20 -146.22 133.58 20.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.27 -0.894 . . . . 0.0 109.429 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.702 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 2.7 ptpp? -55.38 -14.4 1.89 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.703 0.763 . . . . 0.0 109.518 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -92.9 -16.08 49.61 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -137.31 28.58 2.77 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 3.7 p90 -89.17 111.71 22.55 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 122.304 1.05 . . . . 0.0 109.814 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.56 167.12 10.0 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.873 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.439 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.6 tt0 -152.84 157.56 40.9 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.665 -1.272 . . . . 0.0 110.855 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.543 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.3 tp-100 -159.25 146.53 17.18 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 106.214 -1.773 . . . . 0.0 106.214 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.615 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.1 22.62 0.43 Allowed 'General case' 0 C--N 1.296 -1.726 0 O-C-N 120.954 -1.091 . . . . 0.0 109.505 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.472 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 80.72 -5.75 1.7 Allowed 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.718 -0.614 . . . . 0.0 110.849 178.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . 0.475 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 31.8 mttm -90.5 116.86 67.34 Favored Pre-proline 0 C--N 1.294 -1.824 0 O-C-N 121.22 -0.925 . . . . 0.0 109.483 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.527 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 36.0 Cg_exo -49.52 165.9 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.303 0 CA-C-N 120.026 1.045 . . . . 0.0 112.13 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 42.2 m-85 -170.13 138.68 1.7 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.24 -0.912 . . . . 0.0 109.776 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.3 m -69.57 152.84 44.3 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.343 -2.466 . . . . 0.0 104.343 174.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.423 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -57.0 -56.9 15.78 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -45.85 -30.61 1.76 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.462 -0.773 . . . . 0.0 109.731 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . 0.593 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 81.0 m -81.23 -60.96 2.09 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.262 -0.898 . . . . 0.0 108.806 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.583 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -57.42 -53.63 55.96 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.124 0.488 . . . . 0.0 110.187 -179.595 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.583 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -49.83 -43.47 48.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.981 -1.074 . . . . 0.0 109.108 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 60.0 tttt -55.77 -21.06 17.15 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.104 -0.997 . . . . 0.0 109.46 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 4.8 mt -91.92 -56.75 2.97 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.28 -0.887 . . . . 0.0 110.194 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -98.85 30.25 3.43 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.192 -0.943 . . . . 0.0 109.438 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.493 1.69 0 O-C-N 120.836 -1.165 . . . . 0.0 109.224 179.603 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.9 ttm . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.76 -35.37 0.38 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.943 -1.098 . . . . 0.0 108.86 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.619 ' CD1' ' H ' ' A' ' 3' ' ' LEU . 5.6 mp -59.57 -63.6 1.24 Allowed 'General case' 0 C--N 1.299 -1.587 0 CA-C-O 121.901 0.858 . . . . 0.0 109.248 179.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -91.41 27.47 1.95 Allowed 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' O ' ' C ' ' A' ' 6' ' ' ILE . . . -118.55 -10.09 8.84 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.041 -1.624 . . . . 0.0 109.041 -178.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.527 ' CG1' ' H ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -4.28 -85.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.288 -2.102 0 CA-C-N 113.762 -1.219 . . . . 0.0 112.619 177.888 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.646 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -166.21 -108.6 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.859 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.345 -179.113 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.646 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -154.1 -62.44 0.02 OUTLIER Pre-proline 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.574 -177.011 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -43.15 -44.33 9.82 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 121.208 1.467 . . . . 0.0 110.957 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -103.8 -20.94 13.76 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.05 -6.56 86.46 Favored Glycine 0 N--CA 1.484 1.848 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 8' ' ' MET . 11.5 t -168.92 -72.77 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.513 -0.992 . . . . 0.0 110.109 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -164.8 -48.41 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.242 -0.911 . . . . 0.0 109.614 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -161.88 -45.87 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.385 -0.822 . . . . 0.0 109.643 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -149.94 5.49 0.58 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.259 -0.901 . . . . 0.0 109.981 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.551 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 106.53 23.25 7.31 Favored Glycine 0 N--CA 1.497 2.715 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.642 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 39.3 p -79.93 130.02 34.96 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.318 -1.107 . . . . 0.0 109.511 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.551 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -148.81 126.09 11.5 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.857 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.515 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -81.27 130.21 34.93 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.979 -1.076 . . . . 0.0 109.895 -179.68 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.47 133.03 34.49 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.46 142.67 39.04 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.017 -1.052 . . . . 0.0 108.595 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.8 t -136.25 109.93 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 CA-C-O 121.965 0.888 . . . . 0.0 109.992 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 9.4 m-70 -85.72 103.84 14.88 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.8 t -72.53 109.95 5.2 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.643 -1.223 . . . . 0.0 107.796 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.491 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -80.38 -39.29 28.69 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.166 -0.959 . . . . 0.0 109.588 -178.86 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 8.7 t0 -67.65 3.15 1.5 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.0 108.89 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.3 mt -139.63 -28.6 0.76 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.492 -0.755 . . . . 0.0 109.093 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.548 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 82.55 12.88 0.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 122.124 -0.36 . . . . 0.0 110.432 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.4 mtp-105 -94.87 -178.27 4.45 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.854 -1.154 . . . . 0.0 109.72 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 40.7 m-20 -138.38 115.98 11.35 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.5 t -117.16 157.69 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 CA-C-O 121.666 0.746 . . . . 0.0 110.145 -179.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.18 130.32 38.99 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -116.73 115.88 26.47 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.642 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -61.37 138.48 58.25 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.417 ' CG1' ' O ' ' A' ' 34' ' ' ARG . 11.5 m -160.33 -169.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.438 0 CA-C-O 121.788 0.804 . . . . 0.0 109.241 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.502 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.7 p -145.18 165.13 29.23 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 178.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -74.16 43.93 1.3 Allowed Glycine 0 C--N 1.292 -1.887 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.8 OUTLIER -144.27 3.99 1.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.684 -0.892 . . . . 0.0 108.943 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.0 m -90.12 149.51 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.116 -0.99 . . . . 0.0 110.05 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -85.31 142.48 29.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.829 -1.17 . . . . 0.0 108.045 178.791 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.4 HD13 HG21 ' A' ' 41' ' ' ILE . 94.3 mt -47.77 -54.9 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.081 -1.012 . . . . 0.0 109.041 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.2 -17.04 10.03 Favored Glycine 0 N--CA 1.484 1.882 0 N-CA-C 108.224 -1.95 . . . . 0.0 108.224 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -70.84 -29.31 69.45 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.319 -1.912 . . . . 0.0 108.319 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.26 -36.36 12.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.1 mtm -51.29 -37.02 45.21 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.7 tp -69.89 -65.95 0.65 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.461 0.648 . . . . 0.0 110.66 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.415 ' NZ ' ' O ' ' A' ' 43' ' ' GLY . 29.9 mtmm -53.81 -55.7 24.17 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.41 -0.806 . . . . 0.0 111.467 -178.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 62.2 tp -45.98 -48.67 16.5 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.875 -1.14 . . . . 0.0 109.958 -179.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.9 t -67.8 -46.1 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.972 -1.08 . . . . 0.0 109.633 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -45.28 -38.43 5.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.284 -0.885 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -66.59 -44.69 81.48 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.369 -0.832 . . . . 0.0 109.992 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -60.13 -65.18 0.72 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.011 -1.056 . . . . 0.0 108.361 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.5 t70 76.44 80.83 0.09 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.964 0.887 . . . . 0.0 110.561 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.529 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.32 140.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -69.18 35.67 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.376 -0.827 . . . . 0.0 109.946 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' A' ' 54' ' ' VAL . 11.6 ttmm -78.44 147.12 34.12 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.989 -1.07 . . . . 0.0 109.024 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.522 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -61.86 107.03 0.77 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.537 -0.727 . . . . 0.0 109.377 179.805 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.511 ' O ' ' N ' ' A' ' 61' ' ' HIS . 75.8 m95 -106.42 -35.12 7.2 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.373 -0.83 . . . . 0.0 110.224 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.405 ' C ' ' O ' ' A' ' 58' ' ' TRP . 1.5 t -41.57 -51.21 3.99 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.457 -0.777 . . . . 0.0 109.826 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -56.6 -37.73 71.06 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.522 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 11.1 m-70 -72.64 134.79 45.28 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-O 121.649 0.738 . . . . 0.0 109.849 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -145.95 174.83 10.92 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 2.1 mm? -94.54 141.02 29.08 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.885 -1.134 . . . . 0.0 109.978 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.497 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -125.32 151.12 46.46 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.674 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.541 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.03 93.64 4.58 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.041 -1.037 . . . . 0.0 108.652 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -54.72 -24.21 21.11 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.179 -0.951 . . . . 0.0 111.043 -179.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.51 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -67.97 -9.44 45.43 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -133.78 -12.53 2.61 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.955 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 52.49 45.74 28.0 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.0 t -112.13 -171.49 1.86 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.393 0.616 . . . . 0.0 109.697 -178.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.544 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.89 99.14 5.4 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 177.147 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -60.3 83.94 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 122.594 1.188 . . . . 0.0 110.608 -176.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.4 pp -118.97 6.97 11.36 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 178.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.512 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -83.63 57.31 4.01 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.4 m -49.71 -11.65 0.06 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.056 -1.028 . . . . 0.0 109.126 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.512 ' H ' ' C ' ' A' ' 74' ' ' LYS . 41.1 m80 -64.45 150.06 47.28 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.404 -0.81 . . . . 0.0 109.786 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 78.8 m95 54.98 -129.26 2.16 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.756 -0.59 . . . . 0.0 110.319 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -156.24 -163.66 1.51 Allowed 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 118.262 -1.375 . . . . 0.0 112.886 -177.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.522 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.3 mp -69.03 -56.06 8.92 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -44.82 -46.29 10.6 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.731 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.496 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -58.3 -31.24 67.31 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.768 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.496 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -85.11 -46.23 11.32 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.13 14.32 7.19 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 108.631 -1.787 . . . . 0.0 108.631 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.538 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 35.8 mt -72.61 161.53 4.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.726 -0.867 . . . . 0.0 109.902 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.38 -171.97 1.18 Allowed 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.61 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.45 -20.02 65.44 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 109.993 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.506 ' OD2' ' N ' ' A' ' 88' ' ' ALA . 46.0 p-10 -79.92 -21.0 44.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.506 ' N ' ' OD2' ' A' ' 87' ' ' ASP . . . -103.47 112.39 25.27 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -98.41 174.5 6.44 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.035 -1.04 . . . . 0.0 110.317 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.3 mt -138.13 179.69 6.3 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.913 0.863 . . . . 0.0 109.368 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.482 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.3 mt-30 -129.81 168.55 16.39 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -131.39 99.5 4.85 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.91 155.4 30.26 Favored Pre-proline 0 N--CA 1.494 1.753 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.729 -176.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo . . . . . 0 N--CA 1.49 1.305 0 C-N-CA 123.255 2.636 . . . . 0.0 112.744 178.51 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -75.9 -83.3 0.07 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.245 -0.909 . . . . 0.0 109.641 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' B' ' 544' ' ' ARG . 8.1 pt-20 -134.19 1.48 3.22 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.515 -0.741 . . . . 0.0 109.536 -179.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.552 ' CD ' ' H ' ' B' ' 544' ' ' ARG . 0.4 OUTLIER -38.4 136.34 0.68 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.744 -0.598 . . . . 0.0 110.406 -179.555 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -115.03 -51.27 2.73 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.605 -0.684 . . . . 0.0 110.566 -178.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . 0.43 ' O ' ' O ' ' B' ' 545' ' ' ARG . . . -56.39 -116.52 0.01 OUTLIER Glycine 0 N--CA 1.491 2.338 0 O-C-N 121.38 -0.825 . . . . 0.0 111.532 -178.05 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.541 ' H ' ' H ' ' B' ' 556' ' ' ILE . 2.4 m -168.92 120.35 0.76 Allowed 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 -178.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.8 mp -56.35 134.97 53.97 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 120.818 -1.176 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -84.61 104.26 14.44 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 178.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.3 t -49.38 126.08 12.41 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 122.139 0.971 . . . . 0.0 109.89 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.18 -35.95 4.63 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 106.381 -2.688 . . . . 0.0 106.381 -177.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.8 m -103.53 -35.99 8.12 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.42 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 55.25 56.07 6.83 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.819 1.295 . . . . 0.0 109.861 -178.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -140.94 124.1 9.93 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -43.57 134.73 7.07 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 CA-C-N 120.461 1.2 . . . . 0.0 114.956 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.541 ' H ' ' H ' ' B' ' 547' ' ' SER . 41.2 mt -92.88 98.3 8.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' B' ' 557' ' ' THR . 7.4 p -98.48 92.54 5.7 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.196 -0.94 . . . . 0.0 111.398 -177.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.56 -96.26 0.16 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 107.421 -2.271 . . . . 0.0 107.421 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.467 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 7.2 mmt180 -114.88 153.09 31.12 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 177.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -144.49 126.79 15.77 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.923 -1.111 . . . . 0.0 111.373 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.3 mt -90.38 146.05 6.67 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 10.1 m -121.71 146.28 47.18 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 122.008 0.908 . . . . 0.0 109.018 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.762 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.27 -128.73 0.27 Allowed 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.546 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.6 mtt -66.0 26.19 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.531 -0.731 . . . . 0.0 109.081 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.762 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.08 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.46 147.78 28.53 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -94.46 174.59 7.05 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.212 -0.93 . . . . 0.0 108.556 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.9 136.49 7.99 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.767 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.579 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -56.84 116.29 12.78 Favored Pre-proline 0 C--N 1.3 -1.575 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 39.1 Cg_exo -46.67 -10.2 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.471 0 CA-C-N 120.359 1.164 . . . . 0.0 111.399 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' B' ' 569' ' ' HIS . 14.0 mt-10 -98.07 -52.08 3.82 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 122.019 0.914 . . . . 0.0 110.066 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.443 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 20.4 m170 -58.64 -4.17 0.39 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 120.949 -1.094 . . . . 0.0 109.764 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.485 ' H ' ' C ' ' B' ' 571' ' ' GLU . 17.0 t80 -128.09 58.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . 0.402 ' CG1' ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.31 177.45 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.709 0.766 . . . . 0.0 111.359 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.471 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.48 147.36 35.92 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.84 74.35 3.58 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 116.595 -2.042 . . . . 0.0 110.033 179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -154.14 -65.61 0.14 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 102.436 -3.172 . . . . 0.0 102.436 172.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -111.04 82.06 1.53 Allowed 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.296 -2.229 . . . . 0.0 105.238 177.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . 0.597 ' CD1' ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.0 15.4 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -176.677 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.5 -36.66 16.3 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 119.595 -1.941 . . . . 0.0 113.016 -178.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.4 tp60 -159.76 139.8 11.7 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 119.359 -2.088 . . . . 0.0 115.179 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.471 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.1 tp -139.53 168.7 19.22 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.2 m-20 -150.2 133.53 16.41 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.156 -0.965 . . . . 0.0 109.264 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 9.0 ptpt -51.3 -18.11 0.89 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.482 -0.761 . . . . 0.0 109.432 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -19.32 53.11 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 -179.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 586' ' ' THR . . . . . 0.404 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.7 p -134.31 25.58 3.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.559 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.6 109.87 21.02 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.339 1.066 . . . . 0.0 109.897 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.18 159.28 15.68 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 179.647 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.6 tt0 -154.39 156.94 37.77 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.624 1.202 . . . . 0.0 111.147 -178.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.438 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 2.4 pt20 -157.25 145.79 19.57 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.677 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.47 23.82 0.65 Allowed 'General case' 0 C--N 1.289 -2.033 0 O-C-N 121.318 -0.864 . . . . 0.0 109.277 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 83.41 -7.91 1.12 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.915 -0.491 . . . . 0.0 111.958 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -85.72 115.82 63.16 Favored Pre-proline 0 C--N 1.296 -1.738 0 O-C-N 120.966 -1.084 . . . . 0.0 110.763 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 29.1 Cg_exo -53.99 161.92 4.45 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 CA-C-N 120.018 1.042 . . . . 0.0 112.436 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.2 m-85 -171.47 141.68 1.56 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.473 -0.767 . . . . 0.0 109.621 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.0 m -71.21 154.58 41.56 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 104.434 -2.432 . . . . 0.0 104.434 174.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.464 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.03 -55.32 36.48 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.76 -27.89 1.35 Allowed 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.648 -0.657 . . . . 0.0 109.47 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 52.4 m -85.27 -56.99 3.26 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 2.3 t80 -57.93 -54.23 49.32 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.46 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.06 -39.58 56.33 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.0 108.549 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.69 -30.75 56.59 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.533 -0.73 . . . . 0.0 110.036 -179.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.36 -57.48 2.49 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.246 -0.909 . . . . 0.0 111.761 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.51 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 5.7 m-85 -88.81 24.58 2.0 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.106 -0.996 . . . . 0.0 110.517 -178.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.51 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 2.3 m . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.029 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttm . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.95 -57.79 0.31 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.96 -1.088 . . . . 0.0 108.476 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.425 ' C ' ' N ' ' A' ' 5' ' ' GLY . 77.7 mt -49.03 -87.57 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 121.947 0.88 . . . . 0.0 109.263 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 20.4 t70 43.98 25.36 0.1 Allowed 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.863 0.84 . . . . 0.0 109.211 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.425 ' N ' ' C ' ' A' ' 3' ' ' LEU . . . -65.27 -14.77 60.05 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.13 -1.988 . . . . 0.0 108.13 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.52 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -111.16 -105.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.281 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.547 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -155.38 -99.05 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.274 0 O-C-N 120.531 -1.356 . . . . 0.0 109.883 -179.581 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.547 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -142.94 -61.56 0.02 OUTLIER Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 120.971 -1.081 . . . . 0.0 110.3 -179.429 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.4 ' C ' ' O ' ' A' ' 8' ' ' MET . 60.3 Cg_exo -43.14 -31.85 2.72 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 CA-C-N 120.941 1.372 . . . . 0.0 109.889 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -117.31 -26.3 6.77 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.704 -1.135 . . . . 0.0 108.057 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.96 5.42 66.01 Favored Glycine 0 N--CA 1.486 2.006 0 N-CA-C 109.209 -1.557 . . . . 0.0 109.209 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.5 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 9.0 t -171.39 -47.43 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.43 -1.041 . . . . 0.0 109.692 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 12' ' ' CYS . 2.3 t80 82.48 -40.7 0.11 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -179.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.495 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 162.34 -40.14 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -161.68 3.21 0.06 Allowed 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.274 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.443 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 79.86 38.79 18.73 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 -179.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.1 p -79.19 122.63 26.52 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.622 -0.928 . . . . 0.0 110.218 -179.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.443 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -132.85 122.25 24.14 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.53 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.66 134.72 40.51 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.498 -179.275 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.49 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.66 131.24 34.96 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.244 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -77.57 145.45 36.85 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.069 -1.019 . . . . 0.0 108.589 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.0 t -139.58 130.63 32.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.445 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 43.5 m80 -105.76 103.99 13.61 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.52 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.1 t -75.06 115.51 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 118.514 -1.274 . . . . 0.0 108.668 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.37 -43.02 21.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.323 -0.861 . . . . 0.0 110.227 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 3.2 p-10 -64.26 -11.33 30.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.929 -1.107 . . . . 0.0 109.48 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -122.6 -24.16 4.98 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.542 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 73.03 13.29 4.9 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 -177.638 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.3 mtp180 -89.02 -177.11 5.38 Favored 'General case' 0 C--N 1.307 -1.264 0 O-C-N 121.195 -0.941 . . . . 0.0 109.455 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.445 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 0.8 OUTLIER -138.45 118.46 13.39 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 178.022 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.3 t -118.41 155.93 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.716 0.77 . . . . 0.0 110.486 -178.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.66 131.12 39.16 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.111 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -114.78 112.94 23.57 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.53 -0.732 . . . . 0.0 109.981 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -60.98 104.99 0.42 Allowed 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.5 m -136.0 -169.12 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 121.857 0.837 . . . . 0.0 110.099 -178.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.413 ' C ' ' H ' ' A' ' 38' ' ' GLU . 4.1 p -142.62 171.16 14.43 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.25 47.1 2.86 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 108.585 -1.806 . . . . 0.0 108.585 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.413 ' H ' ' C ' ' A' ' 36' ' ' THR . 1.0 OUTLIER -146.04 0.25 0.82 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.687 -0.89 . . . . 0.0 108.955 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.6 m -90.2 145.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.179 -0.951 . . . . 0.0 109.447 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.534 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -78.91 133.65 36.92 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 177.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -36.45 29.03 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 O-C-N 120.546 -1.347 . . . . 0.0 108.022 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.09 -22.37 49.06 Favored Glycine 0 N--CA 1.484 1.861 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.42 -22.94 78.68 Favored Glycine 0 C--O 1.209 -1.463 0 N-CA-C 108.016 -2.033 . . . . 0.0 108.016 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.19 -33.85 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 61' ' ' HIS . 32.6 mtm -51.97 -39.19 58.93 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.11 -59.97 2.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.746 -0.596 . . . . 0.0 111.457 -178.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -46.37 -56.06 6.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.812 -1.18 . . . . 0.0 110.112 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -46.52 -60.94 2.05 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.02 -1.05 . . . . 0.0 109.76 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 53.1 t -53.25 -47.78 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 120.969 -1.082 . . . . 0.0 110.056 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -45.51 -42.98 11.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.133 -0.979 . . . . 0.0 109.816 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 55.0 mttp -62.94 -43.02 99.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.374 -0.829 . . . . 0.0 110.162 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.441 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -62.0 -66.72 0.5 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.515 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.87 82.57 0.1 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.994 0.902 . . . . 0.0 110.119 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.56 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.2 p -171.41 141.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.571 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.51 ' HZ2' ' CG2' ' B' ' 574' ' ' VAL . 25.7 tptt -67.43 32.68 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.427 -0.795 . . . . 0.0 109.671 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.614 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 20.1 ttpp -78.76 139.71 38.38 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.849 -1.157 . . . . 0.0 109.552 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -49.96 118.42 2.89 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.381 -0.824 . . . . 0.0 109.352 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.63 ' O ' ' CG ' ' A' ' 61' ' ' HIS . 61.2 m95 -118.94 -23.62 6.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.484 -0.76 . . . . 0.0 110.431 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.456 ' C ' ' H ' ' A' ' 61' ' ' HIS . 0.3 OUTLIER -44.85 -54.35 6.51 Favored 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.678 -1.264 . . . . 0.0 110.122 -179.206 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 49.0 t0 -59.8 -2.96 0.44 Allowed 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.436 -0.79 . . . . 0.0 110.076 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.63 ' CG ' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -75.12 149.53 39.05 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 -179.446 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -171.32 151.16 3.04 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.6 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -94.65 144.6 25.48 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.49 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.7 143.01 50.84 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.544 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -103.96 91.01 3.79 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.054 -1.029 . . . . 0.0 108.668 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.409 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.62 -22.62 14.04 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.227 -0.92 . . . . 0.0 111.205 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.46 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -64.43 -21.77 66.75 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 178.312 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.525 ' C ' HH21 ' A' ' 69' ' ' ARG . 15.3 mmtt -120.67 -12.09 8.93 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.38 -178.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.544 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.0 OUTLIER 52.9 46.53 26.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.006 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.58 -174.14 2.41 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.409 0.623 . . . . 0.0 110.125 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.527 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.57 98.39 5.01 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 177.385 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.18 92.31 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 123.04 1.4 . . . . 0.0 110.121 -176.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -125.71 6.21 7.46 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.006 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -82.59 39.83 0.63 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 13.9 p -46.26 -15.11 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.078 -1.014 . . . . 0.0 110.127 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 7.9 m80 -79.27 43.42 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.154 -0.966 . . . . 0.0 110.253 -179.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -176.86 -142.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.025 -1.047 . . . . 0.0 108.573 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.58 166.34 32.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 119.736 -1.853 . . . . 0.0 111.261 -178.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.461 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 6.5 mp -44.76 -59.02 2.72 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -45.64 -36.85 5.13 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.157 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.517 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -62.85 -35.71 80.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.031 -1.068 . . . . 0.0 108.573 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.517 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -92.71 -38.84 11.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.016 -1.053 . . . . 0.0 108.426 178.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.85 12.63 8.38 Favored Glycine 0 N--CA 1.5 2.912 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.545 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 68.1 mt -61.04 156.61 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.433 -1.04 . . . . 0.0 108.519 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.545 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.77 -174.81 1.66 Allowed 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.74 -25.13 66.25 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.374 -0.829 . . . . 0.0 109.803 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -81.14 -6.08 58.42 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.36 112.82 24.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.691 -0.631 . . . . 0.0 109.451 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.0 mmtp -97.66 116.25 29.51 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.117 -0.989 . . . . 0.0 109.255 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.6 mt -99.62 177.81 5.04 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.627 0.727 . . . . 0.0 109.698 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.49 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 7.6 mt-30 -129.84 167.02 18.78 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -133.49 95.62 3.54 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.22 157.03 79.23 Favored Pre-proline 0 N--CA 1.503 2.217 0 O-C-N 121.944 -0.472 . . . . 0.0 111.275 -176.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo . . . . . 0 N--CA 1.497 1.73 0 C-N-CA 122.969 2.446 . . . . 0.0 111.758 178.74 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -71.53 -100.69 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.234 -0.916 . . . . 0.0 109.667 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.519 ' O ' ' O ' ' B' ' 544' ' ' ARG . 5.3 pt-20 -143.82 -4.14 0.86 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.238 -0.914 . . . . 0.0 110.153 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.519 ' O ' ' O ' ' B' ' 543' ' ' GLU . 0.2 OUTLIER 52.87 120.99 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.812 0.815 . . . . 0.0 110.808 179.281 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.416 ' O ' ' O ' ' B' ' 544' ' ' ARG . 22.0 mmt180 -45.64 -93.4 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.967 -1.083 . . . . 0.0 109.909 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -157.56 -105.71 0.22 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.524 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.6 m -159.27 116.6 2.72 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -61.36 135.82 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.021 -1.049 . . . . 0.0 110.346 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.32 103.51 12.76 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 178.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.7 t -50.8 126.54 16.12 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 122.144 0.974 . . . . 0.0 109.527 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.12 5.63 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 106.301 -2.719 . . . . 0.0 106.301 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -106.45 -35.44 7.1 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.413 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.28 56.63 6.21 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 122.659 1.219 . . . . 0.0 109.972 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -140.6 123.55 9.99 Favored Pre-proline 0 C--N 1.294 -1.845 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -44.41 135.81 8.86 Favored 'Trans proline' 0 N--CA 1.494 1.502 0 CA-C-N 120.509 1.217 . . . . 0.0 114.58 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.524 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -95.19 98.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.407 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.8 p -100.91 91.26 4.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.212 -0.93 . . . . 0.0 111.211 -178.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.76 -95.21 0.14 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.356 -2.298 . . . . 0.0 107.356 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.6 mmt-85 -113.4 150.25 32.97 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.4 p -144.71 126.41 15.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.971 -1.081 . . . . 0.0 111.509 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.34 146.74 5.87 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.8 m -118.48 146.63 44.35 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.761 0.791 . . . . 0.0 108.934 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.722 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.17 -129.39 0.26 Allowed 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 121.604 0.716 . . . . 0.0 109.352 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.564 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.8 mtt -65.97 26.42 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.722 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.42 -9.04 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 -178.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.1 mtmt -82.17 162.73 22.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt -105.62 174.52 5.85 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -161.21 136.25 7.52 Favored 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.969 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -55.49 114.7 7.74 Favored Pre-proline 0 C--N 1.301 -1.531 0 N-CA-C 105.525 -2.028 . . . . 0.0 105.525 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.605 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 45.2 Cg_exo -45.67 -12.84 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.527 0 CA-C-N 120.237 1.12 . . . . 0.0 111.408 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' B' ' 569' ' ' HIS . 11.0 mt-10 -95.73 -52.71 3.98 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.988 0.899 . . . . 0.0 110.252 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.438 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.2 m170 -58.35 -4.0 0.33 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.986 -1.071 . . . . 0.0 109.876 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.498 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.4 t80 -128.93 56.35 1.68 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 178.415 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . 0.51 ' CG2' ' HZ2' ' A' ' 55' ' ' LYS . 17.1 m -94.0 178.02 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.814 0.816 . . . . 0.0 110.898 -178.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.446 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.41 143.82 30.03 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.74 73.61 5.79 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.505 -2.078 . . . . 0.0 108.905 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . 0.414 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 34.9 t80 -154.56 -60.13 0.12 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 102.858 -3.016 . . . . 0.0 102.858 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' B' ' 580' ' ' LYS . 31.9 p -113.96 79.12 1.21 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.534 -2.121 . . . . 0.0 105.413 176.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 5.9 mt -51.36 14.7 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.019 -0.992 . . . . 0.0 113.272 -176.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -97.11 -36.84 10.35 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.045 -1.66 . . . . 0.0 112.652 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.605 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.18 140.93 13.38 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 119.617 -1.927 . . . . 0.0 114.636 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.446 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 23.2 tp -134.51 169.97 16.47 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.427 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.5 m-20 -145.49 128.16 16.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.335 -0.853 . . . . 0.0 109.073 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -51.2 -21.53 2.09 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.57 -0.707 . . . . 0.0 109.689 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.12 -19.81 60.25 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.56 28.46 3.97 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.569 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.07 105.72 17.97 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 122.932 1.349 . . . . 0.0 110.088 -179.634 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.528 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -97.51 167.76 10.79 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.5 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.8 tt0 -152.61 157.37 40.9 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.558 1.17 . . . . 0.0 110.711 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.629 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.9 OUTLIER -155.35 146.04 22.23 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 178.773 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.578 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 45.86 23.51 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.012 -1.055 . . . . 0.0 109.991 -179.701 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.68 -5.11 1.55 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.715 -0.615 . . . . 0.0 111.078 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 32.6 mttm -89.61 123.17 67.26 Favored Pre-proline 0 C--N 1.295 -1.8 0 O-C-N 121.161 -0.962 . . . . 0.0 109.241 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.486 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.8 Cg_exo -48.63 163.94 0.25 Allowed 'Trans proline' 0 N--CA 1.489 1.243 0 CA-C-N 120.051 1.054 . . . . 0.0 111.941 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' B' ' 588' ' ' LYS . 11.3 m-85 -170.34 138.43 1.58 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.017 -1.052 . . . . 0.0 110.685 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 39.5 m -75.38 157.39 34.27 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 174.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.476 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.03 -56.69 18.01 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 117.53 -1.668 . . . . 0.0 106.618 178.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.17 -27.29 0.94 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.582 -0.698 . . . . 0.0 109.552 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 87.9 m -85.06 -59.28 2.38 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.484 -0.76 . . . . 0.0 109.01 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -54.69 -49.48 70.56 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.477 ' CD1' ' C ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -55.73 -40.27 72.25 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.14 -28.32 10.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.756 . . . . 0.0 109.52 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.08 -57.48 2.52 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.233 -0.917 . . . . 0.0 112.051 -176.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.629 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 14.6 m-85 -92.23 22.12 4.69 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.809 -1.182 . . . . 0.0 110.598 -178.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.52 ' O ' ' CE1' ' A' ' 76' ' ' HIS . 2.2 m . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.109 -0.995 . . . . 0.0 108.952 179.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.634 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.634 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -151.22 -53.0 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.603 ' C ' ' H ' ' A' ' 5' ' ' GLY . 54.0 mt -46.84 -81.19 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.791 0.805 . . . . 0.0 109.309 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.7 t0 60.43 -6.36 0.09 Allowed 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.931 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.603 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 117.99 -13.12 12.88 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 107.906 -2.078 . . . . 0.0 107.906 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.477 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -120.52 -108.14 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 -179.212 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.636 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -168.06 -102.06 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 O-C-N 120.835 -1.165 . . . . 0.0 109.434 179.851 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.636 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -150.68 -64.26 0.02 OUTLIER Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.087 -1.008 . . . . 0.0 110.986 -179.182 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -44.61 -41.36 14.41 Favored 'Trans proline' 0 N--CA 1.493 1.5 0 CA-C-N 121.262 1.487 . . . . 0.0 110.894 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -105.81 -33.73 7.89 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.253 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.11 4.39 58.48 Favored Glycine 0 N--CA 1.482 1.749 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.407 ' N ' ' O ' ' A' ' 8' ' ' MET . 6.9 t -162.36 -76.89 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.561 -0.964 . . . . 0.0 109.341 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -174.02 -60.23 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.257 -0.902 . . . . 0.0 108.76 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 176.1 -47.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -147.93 3.84 0.73 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.567 -0.708 . . . . 0.0 109.2 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.69 26.22 10.04 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.648 -1.781 . . . . 0.0 108.648 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.453 ' H ' ' HG1' ' A' ' 17' ' ' THR . 6.1 p -97.91 122.07 40.58 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.661 -0.905 . . . . 0.0 109.771 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -127.92 130.11 47.94 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.484 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.528 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -82.98 135.72 34.78 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.189 -0.944 . . . . 0.0 110.013 -179.358 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.48 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.72 131.33 34.58 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.98 144.55 36.65 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 120.9 -1.125 . . . . 0.0 108.326 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.8 t -139.18 108.58 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.749 0.785 . . . . 0.0 110.314 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 14.0 m80 -82.49 105.98 13.99 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.537 ' O ' ' N ' ' A' ' 28' ' ' ASN . 5.4 t -73.45 111.18 7.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 118.807 -1.157 . . . . 0.0 109.607 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.541 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.1 p -76.87 165.58 24.5 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.8 t70 72.81 -44.57 0.6 Allowed 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.541 ' H ' ' C ' ' A' ' 25' ' ' THR . 5.7 mt -94.25 -31.37 14.12 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 70.93 17.6 6.25 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.804 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -89.13 -179.59 5.93 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.698 -1.251 . . . . 0.0 108.872 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 3.1 m-20 -139.91 115.41 9.99 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.3 t -115.25 157.41 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 CA-C-O 121.536 0.684 . . . . 0.0 109.966 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.13 132.76 42.03 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -115.53 112.91 22.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.636 -0.665 . . . . 0.0 110.372 -178.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.65 109.1 0.95 Allowed 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.53 -169.27 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 CA-C-O 121.815 0.817 . . . . 0.0 110.218 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.7 p -143.64 174.55 10.69 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.73 44.01 3.04 Favored Glycine 0 N--CA 1.483 1.801 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -145.37 3.82 1.02 Allowed 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.4 m -89.16 143.3 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 120.92 -1.113 . . . . 0.0 110.072 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.511 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -80.16 141.83 35.33 Favored 'General case' 0 C--N 1.293 -1.881 0 O-C-N 120.888 -1.133 . . . . 0.0 108.126 178.794 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.479 ' C ' ' H ' ' A' ' 43' ' ' GLY . 19.6 mt -47.27 -58.32 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.047 -1.033 . . . . 0.0 109.495 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.38 -13.59 4.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.023 -2.031 . . . . 0.0 108.023 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.6 -28.47 67.36 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.95 -35.58 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.7 mtm -51.02 -37.72 46.91 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.32 -63.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.836 -0.54 . . . . 0.0 109.843 -179.192 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 32.8 mttt -53.34 -56.54 15.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.942 . . . . 0.0 111.37 -178.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.6 tp -45.46 -34.15 3.03 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.846 -1.159 . . . . 0.0 110.215 -177.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 19.4 t -80.46 -44.12 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.985 -1.072 . . . . 0.0 109.114 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -43.11 -33.89 0.96 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.527 0.679 . . . . 0.0 109.969 -178.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mtmt -83.72 -39.76 19.73 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.539 -0.726 . . . . 0.0 110.43 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.9 tp -51.23 -60.58 2.96 Favored 'General case' 0 N--CA 1.484 1.249 0 O-C-N 121.133 -0.979 . . . . 0.0 108.969 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 68.73 78.83 0.22 Allowed 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.861 0.838 . . . . 0.0 110.424 178.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.548 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -173.78 142.07 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.463 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.1 tttt -71.28 39.81 0.06 Allowed 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.554 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.548 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.7 ttmm -77.47 154.15 32.84 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.53 91.2 7.36 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 0.1 OUTLIER -80.59 -44.17 19.39 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 122.129 0.966 . . . . 0.0 109.015 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.533 ' C ' ' H ' ' A' ' 61' ' ' HIS . 58.4 p -39.82 -55.31 1.99 Allowed 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.166 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -52.41 -8.05 0.07 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.191 -0.943 . . . . 0.0 109.517 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.7 OUTLIER -98.27 173.32 7.05 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 122.319 1.057 . . . . 0.0 110.771 -179.233 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' CD2' ' A' ' 61' ' ' HIS . . . -168.19 162.18 12.73 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.4 mm? -94.75 145.9 24.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.182 -0.949 . . . . 0.0 109.347 -179.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.464 ' NE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.11 148.53 50.58 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -106.08 91.07 3.57 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.056 -1.027 . . . . 0.0 108.527 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.64 -21.77 19.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.064 -1.023 . . . . 0.0 111.037 -178.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.499 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -66.07 -17.73 64.89 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' N ' ' O ' ' A' ' 65' ' ' TRP . 19.0 mmtt -125.97 -11.92 6.49 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.623 -178.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.0 mpp_? 53.69 46.41 25.97 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 -177.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.582 ' HG1' ' H ' ' A' ' 71' ' ' TRP . 5.3 t -113.03 -171.62 1.9 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.365 0.602 . . . . 0.0 109.851 -178.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.582 ' H ' ' HG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -128.34 99.46 5.43 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.496 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -60.36 82.28 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.926 0 CA-C-O 122.372 1.082 . . . . 0.0 110.673 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -118.33 5.74 11.86 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.48 55.54 2.32 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 12.6 m -47.77 -25.06 1.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.047 -1.033 . . . . 0.0 109.218 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.1 158.32 13.99 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.487 -0.758 . . . . 0.0 109.461 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 45.1 m95 57.34 -138.16 0.94 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.662 -0.649 . . . . 0.0 110.05 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.63 -162.8 1.38 Allowed 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.527 -1.269 . . . . 0.0 111.583 -179.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.536 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.6 mp -72.46 -56.34 5.57 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -43.02 -49.41 6.07 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.629 -1.168 . . . . 0.0 111.188 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -56.63 -30.6 63.47 Favored 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.475 -178.3 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.519 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -82.88 -49.0 10.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.848 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 118.11 7.83 11.05 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.161 -1.976 . . . . 0.0 108.161 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.544 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 30.3 mt -60.66 161.36 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.544 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -155.75 -163.06 1.42 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.962 -1.086 . . . . 0.0 109.64 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.88 -24.18 59.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.49 -0.756 . . . . 0.0 110.75 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -84.77 3.17 38.81 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.43 -0.794 . . . . 0.0 109.756 -178.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.48 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -91.72 112.68 24.7 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.543 -0.723 . . . . 0.0 109.332 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -97.78 117.87 33.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.92 -1.113 . . . . 0.0 109.894 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.5 mt -103.6 178.01 4.68 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.464 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.7 mt-30 -131.52 157.92 42.28 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -122.79 93.4 3.95 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.817 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.57 149.54 41.82 Favored Pre-proline 0 N--CA 1.504 2.229 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.361 -178.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo . . . . . 0 N--CA 1.496 1.666 0 C-N-CA 122.547 2.165 . . . . 0.0 111.907 179.477 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . 0.436 ' O ' ' O ' ' B' ' 542' ' ' HIS . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . 0.436 ' O ' ' O ' ' B' ' 541' ' ' TYR . 71.2 m80 -61.92 -140.78 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.262 -0.899 . . . . 0.0 109.498 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.421 ' O ' ' C ' ' B' ' 544' ' ' ARG . 20.1 pt-20 -173.62 -24.82 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.23 -0.919 . . . . 0.0 110.102 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.494 ' N ' ' CD ' ' B' ' 544' ' ' ARG . 0.3 OUTLIER 39.88 88.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.572 -0.705 . . . . 0.0 110.3 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -59.14 -77.38 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.378 -0.826 . . . . 0.0 110.294 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -120.83 -90.64 1.16 Allowed Glycine 0 N--CA 1.501 3.017 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.538 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -174.3 122.45 0.29 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.244 -1.151 . . . . 0.0 108.223 -178.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.26 136.17 57.95 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.627 -1.296 . . . . 0.0 110.474 -178.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . 0.445 ' O ' ' N ' ' B' ' 553' ' ' GLN . 0.4 OUTLIER -83.89 103.51 13.22 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 178.094 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.4 t -52.11 128.83 25.89 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 122.315 1.055 . . . . 0.0 110.872 -176.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.71 -25.43 28.34 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 106.433 -2.667 . . . . 0.0 106.433 -178.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 2.0 t -112.78 -29.99 7.22 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' B' ' 549' ' ' CYS . 17.3 mm-40 46.88 57.46 5.61 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 122.525 1.155 . . . . 0.0 112.779 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -142.51 125.92 9.47 Favored Pre-proline 0 C--N 1.286 -2.184 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -44.34 134.94 9.05 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 CA-C-N 120.412 1.183 . . . . 0.0 114.596 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.4 mt -94.37 98.04 7.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.42 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.3 p -100.54 90.94 4.45 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.273 -0.892 . . . . 0.0 111.194 -177.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.11 -96.33 0.16 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.483 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.0 mmt-85 -110.83 150.54 29.0 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 178.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.73 126.26 15.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 111.677 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.27 146.49 6.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 178.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.9 m -119.93 146.45 45.79 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.803 0.811 . . . . 0.0 109.02 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.718 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.21 -129.29 0.27 Allowed 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.517 0.675 . . . . 0.0 109.538 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.56 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 13.7 mtm -66.09 26.57 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.718 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.62 -9.38 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . 0.457 ' HZ1' ' CE ' ' B' ' 564' ' ' MET . 13.1 mtmt -81.53 161.14 23.7 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -103.29 174.4 5.88 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.11 134.9 7.74 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.207 -1.397 . . . . 0.0 109.911 -179.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.556 ' O ' ' N ' ' B' ' 571' ' ' GLU . 4.4 m80 -55.84 114.9 8.28 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 176.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.601 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.22 -12.49 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.534 0 CA-C-N 120.47 1.204 . . . . 0.0 110.703 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' B' ' 569' ' ' HIS . 5.5 mt-10 -94.57 -52.46 4.3 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.046 0.927 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.458 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -60.67 -3.67 0.77 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.958 -1.089 . . . . 0.0 109.812 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.474 ' H ' ' C ' ' B' ' 571' ' ' GLU . 25.5 t80 -128.84 55.78 1.7 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 15.4 m -94.52 178.2 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-O 121.85 0.833 . . . . 0.0 111.24 -178.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.445 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.8 142.59 30.54 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.76 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -92.6 75.22 5.07 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 116.717 -1.993 . . . . 0.0 109.289 178.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -153.05 -51.58 0.1 Allowed 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 102.413 -3.18 . . . . 0.0 102.413 173.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.553 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.1 p -129.64 80.53 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.94 -2.391 . . . . 0.0 105.299 177.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.85 15.1 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -176.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.553 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.99 -37.22 16.54 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 119.733 -1.854 . . . . 0.0 112.112 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.601 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -160.13 139.82 11.23 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 119.624 -1.923 . . . . 0.0 114.907 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.445 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 21.8 tp -135.81 169.35 17.7 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 71.2 m-20 -142.53 143.34 32.46 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.333 -0.855 . . . . 0.0 108.891 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -64.14 -17.24 63.28 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.478 -0.763 . . . . 0.0 109.773 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.59 -17.14 55.56 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.08 27.14 4.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.933 -0.745 . . . . 0.0 109.363 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.517 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -88.72 111.24 21.74 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.593 1.187 . . . . 0.0 109.331 179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.514 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.76 168.89 8.95 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.8 tt0 -151.84 157.07 41.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.729 -1.232 . . . . 0.0 110.797 -178.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.539 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 2.5 tp60 -158.59 146.45 18.12 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 178.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.622 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.24 22.56 0.45 Allowed 'General case' 0 C--N 1.295 -1.783 0 O-C-N 120.911 -1.118 . . . . 0.0 109.547 -179.434 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 0.8 OUTLIER 79.44 -3.69 2.08 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.732 -0.605 . . . . 0.0 110.933 178.519 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -91.03 125.44 58.74 Favored Pre-proline 0 C--N 1.294 -1.81 0 O-C-N 121.265 -0.897 . . . . 0.0 109.39 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.6 Cg_exo -48.87 165.77 0.17 Allowed 'Trans proline' 0 N--CA 1.492 1.404 0 CA-C-N 120.15 1.089 . . . . 0.0 111.955 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.0 m-85 -171.1 136.89 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.9 -1.125 . . . . 0.0 111.066 -178.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 23.3 m -73.05 154.55 40.4 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.446 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.77 -58.14 9.85 Favored 'General case' 0 C--N 1.288 -2.081 0 C-N-CA 117.525 -1.67 . . . . 0.0 106.582 179.28 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -46.04 -26.17 0.69 Allowed 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -85.36 -64.48 1.15 Allowed 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.533 -0.73 . . . . 0.0 109.389 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -50.98 -53.56 32.06 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.847 . . . . 0.0 108.856 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.557 ' N ' ' CD1' ' B' ' 600' ' ' PHE . 0.2 OUTLIER -50.51 -41.87 54.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.38 -24.42 12.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.452 -0.78 . . . . 0.0 109.087 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 3.6 mt -94.16 -56.97 2.66 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.281 -0.887 . . . . 0.0 111.5 -178.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.515 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 51.7 m-85 -105.1 -28.49 10.98 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.136 -0.978 . . . . 0.0 110.953 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.2 p . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.949 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ttt . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -158.76 -49.33 0.06 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.098 -1.001 . . . . 0.0 109.138 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.617 ' C ' ' H ' ' A' ' 5' ' ' GLY . 57.5 mt -44.09 -78.14 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 121.945 0.879 . . . . 0.0 109.792 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 7.5 t0 60.81 -6.56 0.09 Allowed 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.679 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.617 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 116.96 -12.57 14.62 Favored Glycine 0 N--CA 1.492 2.423 0 N-CA-C 108.029 -2.028 . . . . 0.0 108.029 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.479 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -118.48 -109.14 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 -179.129 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.536 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -157.61 -95.1 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 O-C-N 120.392 -1.442 . . . . 0.0 110.439 -179.485 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.536 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -131.05 -54.0 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.567 0 O-C-N 120.96 -1.087 . . . . 0.0 111.685 -179.004 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -55.04 -33.43 83.33 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 CA-C-N 121.078 1.421 . . . . 0.0 110.242 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -114.16 -26.59 7.99 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -82.72 4.92 77.2 Favored Glycine 0 N--CA 1.484 1.866 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.51 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 10.2 t -163.56 -44.17 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.207 -1.172 . . . . 0.0 109.716 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.523 ' OH ' ' NH1' ' A' ' 34' ' ' ARG . 8.2 t80 88.41 -79.98 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.501 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 164.87 -37.14 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.472 -0.768 . . . . 0.0 108.993 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -135.48 0.51 2.77 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 18' ' ' TRP . . . 62.81 44.39 97.54 Favored Glycine 0 N--CA 1.488 2.165 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.574 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -76.92 126.55 31.16 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.416 -1.05 . . . . 0.0 110.379 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.4 ' CD2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -130.68 119.76 22.88 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 177.89 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.533 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.9 127.83 33.9 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.11 -1.036 . . . . 0.0 109.008 -179.375 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.5 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.3 OUTLIER -83.52 134.3 34.84 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 179.447 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 t -78.21 145.68 35.4 Favored 'General case' 0 C--N 1.294 -1.822 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.433 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.5 t -136.81 105.3 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 CA-C-O 121.817 0.817 . . . . 0.0 109.525 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.53 ' CD2' ' OD2' ' A' ' 30' ' ' ASP . 12.1 m80 -78.79 103.71 8.92 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 178.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.5 t -72.28 113.3 9.23 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 118.613 -1.235 . . . . 0.0 107.972 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.532 ' HG1' ' N ' ' A' ' 26' ' ' ASP . 30.3 p -80.84 -36.94 30.83 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.392 -0.817 . . . . 0.0 109.873 -178.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.532 ' N ' ' HG1' ' A' ' 25' ' ' THR . 4.6 m-20 -71.34 9.55 0.77 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.946 -1.096 . . . . 0.0 108.654 179.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.521 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.9 mt -147.06 -29.07 0.37 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.585 -0.697 . . . . 0.0 109.294 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 80.78 12.5 0.84 Allowed 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -179.424 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -94.29 -178.26 4.54 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.997 -1.065 . . . . 0.0 109.495 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.53 ' OD2' ' CD2' ' A' ' 23' ' ' HIS . 3.5 m-20 -136.0 114.99 12.24 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.8 t -112.35 157.59 13.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -132.46 133.99 44.53 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -113.76 113.01 24.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.645 -0.659 . . . . 0.0 109.695 -179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.574 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 14.7 tpt180 -60.12 102.38 0.16 Allowed 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 23.8 m -132.96 -169.75 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 CA-C-O 121.918 0.866 . . . . 0.0 110.854 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.3 p -145.26 176.43 9.55 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.33 46.58 3.04 Favored Glycine 0 C--N 1.295 -1.729 0 N-CA-C 109.153 -1.579 . . . . 0.0 109.153 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -147.01 0.23 0.72 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.203 -1.175 . . . . 0.0 108.669 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 m -89.76 128.21 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 120.97 -1.081 . . . . 0.0 109.691 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 43' ' ' GLY . 7.6 m80 -66.92 144.15 56.41 Favored 'General case' 0 C--N 1.291 -1.957 0 O-C-N 121.001 -1.062 . . . . 0.0 108.887 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.4 mt -46.22 -56.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.194 -0.941 . . . . 0.0 109.365 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.24 -14.86 13.0 Favored Glycine 0 C--N 1.296 -1.661 0 N-CA-C 108.741 -1.744 . . . . 0.0 108.741 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.29 -18.69 77.86 Favored Glycine 0 N--CA 1.485 1.905 0 N-CA-C 109.131 -1.588 . . . . 0.0 109.131 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 t -83.41 -50.76 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.385 -1.068 . . . . 0.0 109.063 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.6 mtm -50.41 -39.66 47.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.867 -1.145 . . . . 0.0 108.542 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.7 tt -56.98 -53.87 53.19 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.1 mttm -67.27 -52.84 35.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.12 -0.988 . . . . 0.0 110.7 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.1 tp -44.77 -40.48 6.11 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.142 -0.974 . . . . 0.0 110.163 -178.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.5 t -78.07 -45.68 27.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.927 -1.108 . . . . 0.0 109.952 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -44.67 -37.43 3.67 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.349 -0.844 . . . . 0.0 109.831 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.523 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.8 mtmp? -75.87 -39.04 57.25 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.46 -0.775 . . . . 0.0 110.775 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.442 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -62.03 -67.56 0.4 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.039 -1.038 . . . . 0.0 109.089 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.76 80.83 0.1 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.97 0.891 . . . . 0.0 110.142 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.546 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.3 p -172.52 142.06 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -68.04 31.83 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.0 110.833 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.546 ' H ' ' C ' ' A' ' 54' ' ' VAL . 1.6 tppp? -79.86 142.15 35.49 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.859 -1.151 . . . . 0.0 108.268 178.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -60.0 115.77 3.67 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.477 -0.765 . . . . 0.0 110.03 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.424 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 71.2 m95 -119.67 -43.79 2.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.569 -0.707 . . . . 0.0 109.788 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -48.67 -56.04 9.63 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.954 -1.091 . . . . 0.0 110.094 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.62 -36.84 47.46 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.133 -0.979 . . . . 0.0 108.904 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.408 ' O ' ' CZ ' ' A' ' 92' ' ' PHE . 14.7 m170 -72.49 128.02 34.34 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.888 0.851 . . . . 0.0 110.586 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.68 160.11 27.89 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.456 ' HA ' ' O ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER -99.7 148.63 24.16 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-O 122.274 1.035 . . . . 0.0 110.031 -178.65 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.47 ' CD1' ' C ' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.07 151.28 48.83 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.191 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -100.73 90.5 4.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.8 -1.188 . . . . 0.0 108.674 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.405 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 9.2 pt-20 -54.59 -23.17 15.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.17 -0.956 . . . . 0.0 110.91 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.487 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 15.7 mmtp -67.48 -10.7 53.97 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -133.93 -11.48 2.62 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.1 mpp_? 52.92 45.92 27.81 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 5.0 t -111.81 -169.91 1.55 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.282 0.563 . . . . 0.0 109.933 -178.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.489 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -128.24 103.9 7.44 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 177.707 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 10.1 mt -63.23 82.57 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.468 0 O-C-N 120.479 -1.388 . . . . 0.0 110.318 -176.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.2 pp -113.59 15.19 18.98 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.592 ' CB ' ' HZ2' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -84.22 61.11 6.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.647 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.12 -5.86 46.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.066 -1.021 . . . . 0.0 109.419 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.562 ' HD1' ' H ' ' A' ' 76' ' ' HIS . 6.4 m80 -68.79 -53.04 23.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.338 -0.852 . . . . 0.0 110.782 -179.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -97.24 -128.31 0.16 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -153.33 150.79 29.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.411 -1.431 . . . . 0.0 108.867 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 82' ' ' TYR . 1.5 pt? -40.1 -49.32 2.58 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.504 -0.748 . . . . 0.0 111.224 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.438 ' H ' HD21 ' A' ' 79' ' ' LEU . 23.0 t70 -46.91 -34.78 5.76 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.187 -0.945 . . . . 0.0 109.413 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.592 ' HZ2' ' CB ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.77 -30.44 70.65 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.534 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -79.31 -51.66 9.14 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.048 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.6 9.9 5.66 Favored Glycine 0 N--CA 1.51 3.598 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 53.2 mt -60.87 161.86 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 O-C-N 122.2 -0.588 . . . . 0.0 109.446 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -162.53 -159.02 0.54 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.255 -0.903 . . . . 0.0 109.279 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.68 -26.05 60.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.329 -0.857 . . . . 0.0 109.732 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -79.83 -1.81 40.64 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.111 -179.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.5 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.35 113.48 25.82 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.523 -0.736 . . . . 0.0 109.059 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -98.05 115.43 28.21 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.897 -1.127 . . . . 0.0 110.255 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mt -91.54 176.29 6.6 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 178.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.456 ' O ' ' HA ' ' A' ' 63' ' ' LEU . 2.6 mt-30 -142.27 148.24 37.75 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.408 ' CZ ' ' O ' ' A' ' 61' ' ' HIS . 10.0 t80 -111.34 90.88 3.46 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.447 ' CB ' ' CD ' ' A' ' 94' ' ' PRO . 0.1 OUTLIER -107.57 -177.58 0.5 Allowed Pre-proline 0 N--CA 1.504 2.235 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.531 -178.134 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 93' ' ' THR . 37.2 Cg_exo . . . . . 0 N--CA 1.5 1.878 0 C-N-CA 122.639 2.226 . . . . 0.0 112.12 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 51.9 t80 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -82.32 -161.92 0.51 Allowed 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.232 -0.918 . . . . 0.0 109.725 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.423 ' CD ' ' NE ' ' B' ' 545' ' ' ARG . 0.4 OUTLIER -177.42 91.46 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 179.338 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -98.1 65.6 1.75 Allowed 'General case' 0 C--N 1.293 -1.863 0 O-C-N 121.869 -0.519 . . . . 0.0 110.689 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.423 ' NE ' ' CD ' ' B' ' 543' ' ' GLU . 18.5 mmt180 -64.3 -141.58 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.637 -1.289 . . . . 0.0 109.552 179.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . 159.06 -85.82 0.12 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m -166.18 119.51 1.1 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -179.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.27 136.71 58.12 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.887 -1.133 . . . . 0.0 110.527 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . 0.412 ' O ' ' N ' ' B' ' 553' ' ' GLN . 0.1 OUTLIER -83.72 102.86 12.57 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 105.571 -2.011 . . . . 0.0 105.571 178.358 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.21 127.5 14.86 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.175 0.988 . . . . 0.0 110.654 -177.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.57 -26.2 25.47 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 106.788 -2.525 . . . . 0.0 106.788 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.4 t -110.51 -30.93 7.43 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' B' ' 549' ' ' CYS . 18.2 mm-40 47.46 57.04 6.24 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-O 122.711 1.243 . . . . 0.0 112.02 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 37.3 mmtm -142.44 125.58 9.38 Favored Pre-proline 0 C--N 1.287 -2.135 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -44.03 136.41 7.62 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.415 1.184 . . . . 0.0 114.582 -178.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.8 mt -94.9 98.41 7.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.425 ' O ' ' OG1' ' B' ' 557' ' ' THR . 3.6 p -99.48 91.01 4.71 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.998 0.904 . . . . 0.0 111.179 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.06 -96.82 0.16 Allowed Glycine 0 N--CA 1.488 2.126 0 N-CA-C 107.675 -2.17 . . . . 0.0 107.675 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.12 153.31 28.42 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 20.7 p -144.09 126.5 15.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.014 -1.054 . . . . 0.0 111.558 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 51.6 mt -90.03 145.52 7.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.472 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 9.8 m -121.95 146.38 47.2 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-O 121.965 0.888 . . . . 0.0 109.193 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.764 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.34 -128.85 0.26 Allowed 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.8 mtt -65.44 25.63 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.593 -0.692 . . . . 0.0 109.255 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.764 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.07 -8.66 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 -178.082 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.57 148.94 28.87 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -95.13 174.19 7.19 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -159.95 132.05 6.3 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 118.56 -1.256 . . . . 0.0 109.81 -179.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.57 ' C ' ' H ' ' B' ' 571' ' ' GLU . 1.4 m80 -54.56 117.83 14.74 Favored Pre-proline 0 C--N 1.299 -1.593 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 176.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.585 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.1 Cg_exo -48.6 -9.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.303 -1.828 0 CA-C-N 120.48 1.207 . . . . 0.0 110.272 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.57 ' H ' ' C ' ' B' ' 569' ' ' HIS . 7.0 mt-10 -97.58 -52.85 3.63 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.62 0.724 . . . . 0.0 110.56 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -59.96 -2.72 0.44 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.612 -1.305 . . . . 0.0 109.685 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.501 ' H ' ' C ' ' B' ' 571' ' ' GLU . 5.8 t80 -128.06 56.6 1.59 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 178.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 17.0 m -95.1 177.82 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 CA-C-O 121.718 0.77 . . . . 0.0 111.5 -178.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.449 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.87 145.86 30.15 Favored 'General case' 0 N--CA 1.505 2.303 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.72 76.33 3.22 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 116.915 -1.914 . . . . 0.0 109.949 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -152.57 -60.53 0.15 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 101.252 -3.61 . . . . 0.0 101.252 173.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 21.5 p -121.04 81.51 1.79 Allowed 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 111.659 -2.518 . . . . 0.0 104.803 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.9 mp -53.62 16.88 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -176.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.0 -36.9 19.49 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.585 -1.947 . . . . 0.0 112.522 -178.613 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.585 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.27 140.09 12.57 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 119.465 -2.022 . . . . 0.0 115.073 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.449 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.3 tp -139.99 170.48 15.78 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 175.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.5 m-20 -149.38 134.55 18.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.101 -1.0 . . . . 0.0 109.098 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.472 ' CE ' ' O ' ' B' ' 562' ' ' THR . 12.3 ptpt -51.91 -19.37 1.73 Allowed 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.456 -0.778 . . . . 0.0 109.634 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -18.26 55.73 Favored Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -134.05 25.41 3.91 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.557 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.3 109.01 20.12 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 122.5 1.143 . . . . 0.0 110.232 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -104.58 169.0 8.72 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.3 tt0 -152.38 157.23 40.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.678 -1.264 . . . . 0.0 110.781 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.502 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 2.8 tp60 -155.0 146.44 23.06 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 178.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.535 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.56 23.65 0.15 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.997 -1.064 . . . . 0.0 109.909 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 82.49 -5.95 1.35 Allowed 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.816 -0.553 . . . . 0.0 110.768 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -90.27 118.91 69.18 Favored Pre-proline 0 C--N 1.295 -1.78 0 O-C-N 121.158 -0.964 . . . . 0.0 109.652 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.522 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 38.2 Cg_exo -49.27 164.98 0.25 Allowed 'Trans proline' 0 N--CA 1.491 1.335 0 CA-C-N 119.996 1.034 . . . . 0.0 112.288 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.522 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 22.5 m-85 -170.8 139.58 1.52 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.224 -0.923 . . . . 0.0 109.866 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.1 m -70.02 154.63 41.7 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.424 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.08 -55.53 33.79 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 179.183 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.98 -29.32 4.68 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.41 -58.47 3.11 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.613 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -60.27 -59.48 5.35 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.81 -0.556 . . . . 0.0 110.246 -179.764 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.613 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -46.55 -38.7 9.79 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.366 -0.834 . . . . 0.0 109.36 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -63.19 -20.71 65.66 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.542 -0.724 . . . . 0.0 110.855 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 3.0 mt -92.11 -57.3 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.75 -1.219 . . . . 0.0 111.239 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.498 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 10.5 m-85 -96.07 12.03 32.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.16 -0.963 . . . . 0.0 109.905 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 26.4 m . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.25 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.5 mmt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 122.001 0.905 . . . . 0.0 108.948 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 5' ' ' GLY . . . 178.61 -8.33 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.804 -0.814 . . . . 0.0 108.804 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.484 ' C ' ' H ' ' A' ' 5' ' ' GLY . 1.7 mp -43.28 -65.71 0.46 Allowed 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.55 1.167 . . . . 0.0 109.87 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.427 ' C ' ' N ' ' A' ' 6' ' ' ILE . 19.1 t70 -76.91 12.71 1.26 Allowed 'General case' 0 C--N 1.287 -2.137 0 CA-C-N 114.891 -1.05 . . . . 0.0 108.545 -179.336 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -59.54 -13.79 25.12 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 107.432 -2.267 . . . . 0.0 107.432 179.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.5 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -114.61 -110.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 -179.66 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -173.47 -87.97 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.235 0 O-C-N 120.86 -1.15 . . . . 0.0 111.159 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.96 -51.81 0.04 OUTLIER Pre-proline 0 N--CA 1.501 2.096 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -176.373 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -57.1 -37.8 97.33 Favored 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 121.624 1.55 . . . . 0.0 111.407 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.85 -20.59 5.37 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.12 0.88 88.96 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 108.719 -1.752 . . . . 0.0 108.719 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.562 ' O ' ' N ' ' A' ' 14' ' ' ALA . 38.4 t -153.13 -52.62 0.11 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.557 -0.966 . . . . 0.0 109.486 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.499 ' O ' ' CB ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER 61.93 -74.68 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -179.242 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' A' ' 12' ' ' CYS . . . 164.69 -37.78 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -156.63 7.52 0.19 Allowed 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.391 -0.818 . . . . 0.0 109.68 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.49 16.69 70.46 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.198 -1.961 . . . . 0.0 108.198 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.502 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 21.8 p -89.98 124.14 34.49 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.809 -0.818 . . . . 0.0 110.619 -178.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -119.0 122.15 41.52 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 177.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -79.37 128.78 33.76 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.106 -0.996 . . . . 0.0 109.975 -178.837 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.468 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -84.47 133.96 34.46 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.776 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.81 34.59 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -178.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.4 t -135.31 107.31 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 CA-C-O 121.802 0.81 . . . . 0.0 109.117 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -78.62 103.71 8.75 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -71.24 98.92 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.517 ' C ' ' H ' ' A' ' 27' ' ' LEU . 19.7 p -68.19 -48.56 64.91 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.826 -0.546 . . . . 0.0 111.161 -177.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.91 12.22 0.23 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.753 -1.217 . . . . 0.0 109.698 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.517 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -141.36 -24.98 0.72 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 77.15 13.25 2.08 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 122.041 -0.412 . . . . 0.0 110.234 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.5 mtp-105 -96.92 -178.16 4.13 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 120.966 -1.084 . . . . 0.0 109.687 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -137.51 114.23 10.47 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.419 HG12 ' HZ3' ' A' ' 51' ' ' LYS . 30.3 t -110.65 157.65 11.35 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -131.72 135.3 46.73 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.488 ' CD2' ' N ' ' A' ' 33' ' ' LEU . 3.8 mm? -109.15 110.44 21.67 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.685 -0.634 . . . . 0.0 109.416 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.502 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.9 tpt180 -60.87 101.73 0.16 Allowed 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.7 m -133.55 -169.63 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-O 122.187 0.994 . . . . 0.0 110.742 -178.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.7 p -142.4 174.51 10.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.26 45.51 3.04 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -146.61 4.87 0.9 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.595 -0.944 . . . . 0.0 108.948 179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.5 m -89.83 138.28 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.122 -0.986 . . . . 0.0 110.335 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.5 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.1 m-70 -82.0 146.12 29.88 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.025 -1.047 . . . . 0.0 108.585 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 73.7 mt -47.36 -56.5 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.953 -1.092 . . . . 0.0 109.896 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.02 -14.89 4.57 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.378 -1.889 . . . . 0.0 108.378 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.5 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.08 -27.49 58.06 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 108.511 -1.835 . . . . 0.0 108.511 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.405 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.18 -39.32 19.15 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 38.6 mtm -51.39 -40.05 58.44 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -62.95 -58.41 7.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.623 -0.673 . . . . 0.0 109.931 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -54.95 -59.75 4.31 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.425 -0.797 . . . . 0.0 111.234 -178.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.7 tp -45.51 -38.26 6.13 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.958 -1.089 . . . . 0.0 109.716 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.24 -53.93 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -45.34 -47.25 13.32 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.188 0.518 . . . . 0.0 110.975 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.419 ' HZ3' HG12 ' A' ' 31' ' ' VAL . 7.3 mtmp? -60.85 -58.06 10.06 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.229 -0.919 . . . . 0.0 110.634 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.6 tp -55.52 -49.99 71.15 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 t70 66.05 74.96 0.35 Allowed 'General case' 0 C--N 1.299 -1.617 0 CA-C-O 121.805 0.812 . . . . 0.0 109.989 178.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.479 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.31 144.68 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.999 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.979 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' CB ' ' B' ' 576' ' ' ALA . 20.6 mmtt -71.84 45.29 0.11 Allowed 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.535 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 40.8 tttm -76.26 171.18 14.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.415 -0.803 . . . . 0.0 110.429 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 8.4 m-20 -50.89 91.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.366 -0.833 . . . . 0.0 110.357 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 67.7 m95 -113.55 -13.51 12.76 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 122.282 1.039 . . . . 0.0 109.102 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.6 t -57.39 -54.11 50.47 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-O 121.778 0.799 . . . . 0.0 109.787 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.445 ' O ' ' O ' ' A' ' 94' ' ' PRO . 54.5 t0 -91.26 12.56 19.86 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.76 -0.588 . . . . 0.0 110.684 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.46 134.77 48.09 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.124 -0.985 . . . . 0.0 110.023 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.74 148.52 4.36 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.572 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 1.3 mm? -95.6 148.35 22.61 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.859 -1.151 . . . . 0.0 110.611 -178.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.522 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -129.94 137.65 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -99.7 91.67 4.97 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.483 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 16.5 pt-20 -57.51 -22.01 41.53 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.965 -1.084 . . . . 0.0 110.553 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.494 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -62.95 -13.38 34.05 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 177.762 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.444 ' N ' ' C ' ' A' ' 66' ' ' GLU . 18.9 mmtt -130.85 -12.8 3.71 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.477 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.4 mpp_? 54.11 45.9 26.52 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 -177.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.61 -175.42 2.67 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.647 0.737 . . . . 0.0 109.957 -178.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.467 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.67 102.35 7.3 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 177.655 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -62.01 87.01 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.262 0 O-C-N 120.431 -1.418 . . . . 0.0 110.433 -176.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.7 pp -124.52 10.91 8.54 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 82.61 7.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.209 -0.932 . . . . 0.0 108.895 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.47 -12.06 60.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.095 -1.003 . . . . 0.0 109.984 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.669 ' H ' ' CD2' ' A' ' 76' ' ' HIS . 0.6 OUTLIER -90.78 44.07 1.18 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.866 -1.147 . . . . 0.0 109.468 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.521 ' CG ' ' O ' ' A' ' 76' ' ' HIS . 1.3 m0 -173.42 -169.87 0.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.647 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -139.97 -169.19 2.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.898 -1.126 . . . . 0.0 109.692 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.511 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 5.8 mp -65.25 -60.0 3.47 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -45.68 -52.83 10.24 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.857 0.837 . . . . 0.0 109.804 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.647 ' CG ' ' H ' ' A' ' 78' ' ' THR . 36.7 mmtt -45.43 -55.96 5.53 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.639 0.733 . . . . 0.0 109.731 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -41.73 69.63 Favored 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 119.827 -0.749 . . . . 0.0 109.155 -179.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.3 11.53 6.73 Favored Glycine 0 N--CA 1.5 2.908 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 43.1 mt -71.23 160.71 5.08 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.606 -0.937 . . . . 0.0 109.513 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.76 -165.15 0.42 Allowed 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.94 -22.23 62.25 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.417 -0.802 . . . . 0.0 110.098 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -79.93 -10.0 59.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.157 -0.964 . . . . 0.0 108.844 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.468 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.93 112.83 25.09 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.9 115.59 27.97 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 109.964 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.4 mt -90.12 176.22 6.85 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.466 ' NE2' ' CZ2' ' A' ' 64' ' ' TRP . 1.2 mt-30 -140.63 148.93 41.64 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.1 OUTLIER -96.0 142.52 28.11 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.1 t -155.1 143.08 14.27 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . 0.445 ' O ' ' O ' ' A' ' 60' ' ' ASP . 90.3 Cg_endo . . . . . 0 N--CA 1.492 1.412 0 C-N-CA 122.036 1.824 . . . . 0.0 111.345 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . 0.494 ' C ' ' H ' ' B' ' 544' ' ' ARG . 31.5 m80 -67.66 -140.84 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.203 -0.935 . . . . 0.0 109.65 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . 0.434 ' C ' ' H ' ' B' ' 545' ' ' ARG . 10.1 pt-20 -59.5 -2.43 0.33 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.348 -0.845 . . . . 0.0 109.651 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.494 ' H ' ' C ' ' B' ' 542' ' ' HIS . 22.2 mmt180 -50.57 -13.51 0.14 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.234 -0.917 . . . . 0.0 109.577 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' B' ' 543' ' ' GLU . 21.6 mtp180 -66.93 -80.92 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.164 -0.96 . . . . 0.0 109.844 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -149.55 -109.36 0.49 Allowed Glycine 0 N--CA 1.496 2.657 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -166.58 118.61 0.99 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.322 -1.105 . . . . 0.0 108.047 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.3 mp -59.38 135.56 57.69 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.888 -1.133 . . . . 0.0 110.653 -178.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.89 103.97 13.59 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 18.3 t -51.65 127.21 19.83 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.201 1.001 . . . . 0.0 109.659 -177.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.74 -34.21 5.6 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.142 -2.783 . . . . 0.0 106.142 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.1 m -106.23 -36.2 6.95 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.429 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.0 mm-40 55.72 56.37 6.21 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 122.639 1.209 . . . . 0.0 109.942 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.7 mmtm -140.53 124.06 10.32 Favored Pre-proline 0 N--CA 1.496 1.851 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -44.2 135.17 8.58 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 120.492 1.211 . . . . 0.0 114.855 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.54 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.8 mt -94.04 99.3 9.31 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 80.9 p -100.82 91.7 4.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.307 -0.871 . . . . 0.0 111.238 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.96 -96.59 0.16 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 107.334 -2.306 . . . . 0.0 107.334 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.489 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.3 mmt-85 -112.12 152.9 27.75 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.4 p -145.18 126.13 14.5 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.978 -1.076 . . . . 0.0 111.577 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.8 mt -90.54 146.07 6.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 178.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.468 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 8.9 m -120.0 146.54 45.76 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 121.916 0.865 . . . . 0.0 109.283 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.757 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.19 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.803 0 CA-C-O 121.605 0.717 . . . . 0.0 109.406 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.548 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.1 mtt -65.66 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.688 0 O-C-N 121.617 -0.677 . . . . 0.0 109.272 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.757 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.46 -9.05 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.17 159.99 24.49 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -103.84 174.68 5.77 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -160.09 133.58 6.98 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.268 -1.373 . . . . 0.0 110.005 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.568 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -54.16 114.3 6.35 Favored Pre-proline 0 C--N 1.302 -1.49 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.554 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 36.8 Cg_exo -46.96 -9.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.422 0 CA-C-N 120.331 1.154 . . . . 0.0 111.535 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.568 ' N ' ' O ' ' B' ' 569' ' ' HIS . 11.9 mt-10 -98.69 -52.92 3.45 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.011 0.91 . . . . 0.0 110.008 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.514 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -56.91 -4.86 0.19 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.917 -1.114 . . . . 0.0 109.87 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.514 ' H ' ' C ' ' B' ' 571' ' ' GLU . 30.1 t80 -125.47 53.7 1.53 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 16.9 m -93.1 178.26 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 122.17 0.986 . . . . 0.0 110.487 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.466 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.42 150.93 28.14 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.21 -179.499 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . 0.568 ' CB ' ' NZ ' ' A' ' 55' ' ' LYS . . . -96.24 76.85 3.03 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 117.219 -1.792 . . . . 0.0 110.031 178.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . 0.48 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 27.9 t80 -152.65 -44.38 0.1 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 173.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.2 p -137.3 125.62 23.28 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 111.71 -2.495 . . . . 0.0 106.624 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.78 13.72 0.78 Allowed 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.055 -1.028 . . . . 0.0 111.84 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.403 ' HD3' ' H ' ' B' ' 581' ' ' GLN . 0.0 OUTLIER -91.93 -39.7 11.56 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-N 121.614 2.007 . . . . 0.0 115.204 -175.272 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.554 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.97 141.91 8.6 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 122.377 2.353 . . . . 0.0 116.09 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.466 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 20.9 tp -140.38 168.66 19.29 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 174.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 68.7 m-20 -147.67 134.98 20.62 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.066 -1.021 . . . . 0.0 109.163 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.468 ' CE ' ' O ' ' B' ' 562' ' ' THR . 11.3 ptpt -55.4 -14.13 1.77 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.73 0.776 . . . . 0.0 109.53 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -95.62 -14.97 45.04 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.6 p -136.41 26.79 3.14 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.94 -0.741 . . . . 0.0 109.083 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.56 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 2.8 p90 -88.25 109.39 19.9 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 122.32 1.057 . . . . 0.0 109.176 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.88 159.35 15.14 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.442 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.5 tt0 -155.24 157.25 37.0 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 122.699 1.237 . . . . 0.0 111.456 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.442 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 3.7 pt20 -160.9 146.19 14.33 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.702 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.32 22.97 1.54 Allowed 'General case' 0 C--N 1.287 -2.129 0 O-C-N 121.263 -0.898 . . . . 0.0 109.155 -178.572 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.57 -7.07 1.47 Allowed 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.775 -0.578 . . . . 0.0 111.819 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -87.83 116.12 65.18 Favored Pre-proline 0 C--N 1.294 -1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 110.643 -178.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 34.6 Cg_exo -53.05 164.31 1.75 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 CA-C-N 119.883 0.994 . . . . 0.0 112.147 178.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.0 m-85 -171.04 139.91 1.46 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.287 -0.883 . . . . 0.0 110.229 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.53 155.14 40.96 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 103.529 -2.767 . . . . 0.0 103.529 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.462 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.15 -55.91 28.95 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.062 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.35 -26.97 0.92 Allowed 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.682 -0.636 . . . . 0.0 109.455 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 23.2 m -84.8 -60.23 2.12 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.479 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.6 OUTLIER -55.76 -54.66 41.68 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.684 . . . . 0.0 109.273 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.479 ' N ' ' CD2' ' B' ' 600' ' ' PHE . 0.1 OUTLIER -48.71 -41.79 32.99 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.628 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.78 -26.95 15.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 109.016 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.3 mt -92.68 -57.25 2.73 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.195 -0.941 . . . . 0.0 111.25 -177.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' O ' ' B' ' 605' ' ' CYS . 11.6 m-85 -102.08 32.13 3.62 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.318 -0.864 . . . . 0.0 110.022 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.409 ' O ' ' O ' ' B' ' 604' ' ' PHE . 9.5 t . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 117.923 -1.037 . . . . 0.0 109.713 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ttt . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 3' ' ' LEU . . . -172.78 -34.09 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.294 -0.879 . . . . 0.0 109.639 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.482 ' O ' ' N ' ' A' ' 5' ' ' GLY . 74.9 mt -40.29 -81.07 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 122.058 0.933 . . . . 0.0 109.794 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 18.0 t70 42.65 23.86 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.803 0 CA-C-O 121.949 0.88 . . . . 0.0 109.33 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 3' ' ' LEU . . . -65.89 -12.83 58.22 Favored Glycine 0 N--CA 1.486 1.995 0 N-CA-C 108.448 -1.861 . . . . 0.0 108.448 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.507 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -111.37 -104.03 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.709 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -179.069 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.597 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -160.96 -102.62 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.168 0 O-C-N 120.588 -1.32 . . . . 0.0 109.985 -179.45 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.597 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -146.72 -64.01 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.17 -0.957 . . . . 0.0 110.288 -179.297 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.44 -34.21 14.1 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 CA-C-N 121.483 1.565 . . . . 0.0 109.789 178.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -106.66 -29.41 9.62 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.36 4.92 82.75 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.585 ' SG ' ' N ' ' A' ' 13' ' ' TYR . 2.1 t 178.19 -91.84 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.964 -0.727 . . . . 0.0 109.242 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.585 ' N ' ' SG ' ' A' ' 12' ' ' CYS . 0.4 OUTLIER 167.75 -51.35 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 -179.485 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.466 ' CB ' ' O ' ' A' ' 13' ' ' TYR . . . 161.39 -45.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -160.09 3.08 0.08 Allowed 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.726 -0.609 . . . . 0.0 109.774 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.492 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 78.49 36.83 28.98 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 p -85.67 122.86 30.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.611 -0.934 . . . . 0.0 110.427 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.492 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -137.81 122.52 18.69 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.788 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.538 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.74 130.11 36.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.225 -0.922 . . . . 0.0 108.717 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.491 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.6 133.7 34.83 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.2 145.5 35.53 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.242 -0.911 . . . . 0.0 109.62 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.5 t -138.16 106.25 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-O 121.9 0.857 . . . . 0.0 109.683 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -80.62 103.71 10.66 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.58 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.2 t -72.41 103.48 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.53 ' C ' ' H ' ' A' ' 27' ' ' LEU . 4.1 p -69.03 -65.55 0.69 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 110.89 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' N ' ' OG1' ' A' ' 25' ' ' THR . 25.7 t70 -49.35 -9.25 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.047 -1.033 . . . . 0.0 110.393 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.53 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.2 mt -120.86 -23.76 5.83 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.383 -0.823 . . . . 0.0 108.941 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.58 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 74.27 13.92 3.82 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 122.143 -0.348 . . . . 0.0 110.406 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.425 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 56.6 mtp85 -97.25 -178.53 4.2 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.925 -1.11 . . . . 0.0 109.791 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 29' ' ' ARG . 83.7 m-20 -138.39 118.24 13.26 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.6 t -120.47 157.9 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.557 0.694 . . . . 0.0 109.629 -179.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.11 136.63 45.94 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -114.46 113.04 23.94 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -60.28 101.97 0.15 Allowed 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 179.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.9 m -132.59 -174.9 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 CA-C-O 121.925 0.869 . . . . 0.0 110.316 -178.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 38' ' ' GLU . 10.7 p -141.11 175.56 9.53 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.59 49.02 3.3 Favored Glycine 0 C--N 1.292 -1.882 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.41 ' H ' ' C ' ' A' ' 36' ' ' THR . 0.7 OUTLIER -145.72 -4.65 0.66 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.44 -1.036 . . . . 0.0 109.021 -179.952 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.404 HG11 ' H ' ' A' ' 36' ' ' THR . 1.2 m -87.5 150.29 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.162 -0.961 . . . . 0.0 110.455 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.467 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -90.3 138.72 31.31 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.608 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.474 ' C ' ' H ' ' A' ' 43' ' ' GLY . 38.7 mt -50.58 -49.03 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.953 -1.092 . . . . 0.0 108.499 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.49 -13.76 3.04 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 108.287 -1.925 . . . . 0.0 108.287 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.474 ' H ' ' C ' ' A' ' 41' ' ' ILE . . . -79.67 -38.56 20.08 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 108.155 -1.978 . . . . 0.0 108.155 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.61 -43.21 94.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.4 mtm -50.95 -32.78 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -77.94 -64.06 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.228 0.537 . . . . 0.0 109.939 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -51.63 -59.38 4.34 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.193 -0.942 . . . . 0.0 110.863 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.82 -55.25 5.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.151 -0.968 . . . . 0.0 108.78 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.2 t -56.81 -52.42 54.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 O-C-N 121.839 -0.538 . . . . 0.0 109.589 179.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -44.55 -40.51 5.75 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.204 -0.935 . . . . 0.0 110.159 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.471 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -71.66 -27.9 63.38 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.2 tp -65.75 -58.63 5.21 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.186 -0.946 . . . . 0.0 109.031 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t0 69.17 72.06 0.26 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.765 0.793 . . . . 0.0 110.698 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.572 ' C ' ' H ' ' A' ' 56' ' ' LYS . 3.1 p -175.25 138.62 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.96 34.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.13 -0.981 . . . . 0.0 109.641 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.572 ' H ' ' C ' ' A' ' 54' ' ' VAL . 6.6 ttpm? -78.03 168.81 19.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.041 -1.037 . . . . 0.0 109.469 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.457 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -50.17 109.36 0.29 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.455 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 44.3 m0 -103.83 -89.47 0.4 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 61' ' ' HIS . 4.9 t -43.6 -48.21 7.59 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.17 -0.956 . . . . 0.0 110.492 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' SER . 9.0 t0 -43.7 -19.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 1.6 p-80 -88.52 167.52 13.36 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 122.021 0.915 . . . . 0.0 109.821 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.54 153.12 4.97 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -94.07 147.16 23.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.973 -1.08 . . . . 0.0 109.288 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.525 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -133.27 137.02 45.86 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.719 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -96.46 91.28 5.73 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.461 ' C ' ' N ' ' A' ' 68' ' ' LYS . 13.3 pt-20 -57.16 -21.99 36.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.806 -1.184 . . . . 0.0 110.197 -178.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -62.16 -15.3 45.14 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 177.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.461 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -130.3 -12.56 4.01 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.755 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.516 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.2 mpp_? 54.42 45.96 26.0 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 -177.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.7 t -114.36 -173.29 2.26 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.443 0.639 . . . . 0.0 110.237 -178.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.425 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -123.95 102.95 8.04 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 177.557 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.1 mt -63.15 88.75 0.03 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.367 -1.458 . . . . 0.0 110.617 -176.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.455 ' H ' ' HE3' ' A' ' 74' ' ' LYS . 3.1 pp -120.78 10.1 10.86 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.54 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -72.22 38.62 0.07 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.134 -0.979 . . . . 0.0 110.846 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -6.84 0.22 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.287 -1.508 . . . . 0.0 108.704 179.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.54 ' H ' ' C ' ' A' ' 74' ' ' LYS . 16.1 t60 -59.86 -77.05 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 110.035 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -82.34 -118.7 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.098 -1.001 . . . . 0.0 109.647 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.466 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -153.75 150.56 28.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.642 -1.286 . . . . 0.0 109.757 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.531 ' O ' ' N ' ' A' ' 82' ' ' TYR . 1.5 pt? -43.86 -47.6 8.25 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.064 -1.022 . . . . 0.0 110.021 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.453 ' H ' HD21 ' A' ' 79' ' ' LEU . 7.2 t70 -47.38 -34.17 6.72 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.312 -0.867 . . . . 0.0 109.518 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.5 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.1 -30.34 70.33 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -179.44 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 79' ' ' LEU . 1.1 t80 -81.37 -49.62 10.46 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 122.82 9.4 6.29 Favored Glycine 0 N--CA 1.512 3.754 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.541 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 47.0 mt -60.87 161.73 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 O-C-N 122.075 -0.662 . . . . 0.0 109.242 179.464 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.39 -168.28 1.49 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.91 . . . . 0.0 109.438 179.356 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.64 -26.55 67.12 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.294 -0.879 . . . . 0.0 109.896 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -76.79 -10.09 59.13 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.13 112.32 24.13 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.4 mmtp -97.54 117.29 31.49 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.944 -1.098 . . . . 0.0 109.837 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.2 mt -95.64 175.62 6.47 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.41 ' NE2' ' CH2' ' A' ' 64' ' ' TRP . 8.1 mt-30 -134.08 161.56 34.51 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 3.4 t80 -122.94 125.62 45.66 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.1 t -140.35 148.2 52.91 Favored Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.36 -0.837 . . . . 0.0 108.866 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo . . . . . 0 N--CA 1.496 1.668 0 C-N-CA 122.315 2.01 . . . . 0.0 111.936 -179.668 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 541' ' ' TYR . . . . . 0.65 ' H ' ' NH2' ' B' ' 545' ' ' ARG . 41.1 t80 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.266 0.555 . . . . 0.0 109.525 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -154.8 -73.35 0.12 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.167 -0.958 . . . . 0.0 109.127 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -121.05 -7.97 9.37 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.625 -0.672 . . . . 0.0 109.391 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 544' ' ' ARG . . . . . 0.477 ' HG2' HH21 ' B' ' 544' ' ' ARG . 1.2 mmt-85 -50.55 -46.96 57.82 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.192 -0.942 . . . . 0.0 109.226 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 545' ' ' ARG . . . . . 0.65 ' NH2' ' H ' ' B' ' 541' ' ' TYR . 11.9 mpt_? -57.06 -111.52 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.364 -0.835 . . . . 0.0 110.109 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -129.67 -83.5 0.33 Allowed Glycine 0 N--CA 1.502 3.041 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 547' ' ' SER . . . . . 0.556 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m -171.44 120.94 0.5 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.109 -1.23 . . . . 0.0 108.331 -178.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.4 mp -58.93 135.84 57.7 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.77 -1.206 . . . . 0.0 110.828 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 549' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -84.14 104.13 13.93 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 178.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.2 t -51.77 127.06 19.68 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 122.137 0.97 . . . . 0.0 109.599 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.84 -33.24 6.15 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 106.199 -2.76 . . . . 0.0 106.199 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.4 m -107.65 -35.94 6.57 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 553' ' ' GLN . . . . . 0.427 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.6 mm-40 55.58 56.38 6.29 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 122.61 1.195 . . . . 0.0 110.038 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -140.62 124.08 10.24 Favored Pre-proline 0 C--N 1.293 -1.863 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -44.05 136.02 7.84 Favored 'Trans proline' 0 N--CA 1.494 1.526 0 CA-C-N 120.441 1.193 . . . . 0.0 115.113 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 556' ' ' ILE . . . . . 0.556 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.7 mt -95.35 97.97 7.37 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 557' ' ' THR . . . . . 0.423 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.2 p -100.07 91.37 4.75 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.227 -0.92 . . . . 0.0 111.279 -177.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.3 -95.18 0.15 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 107.532 -2.227 . . . . 0.0 107.532 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 559' ' ' ARG . . . . . 0.482 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.0 mmt-85 -114.04 152.71 30.59 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 18.6 p -144.63 126.25 15.09 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.947 -1.096 . . . . 0.0 111.605 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -90.74 146.48 6.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 562' ' ' THR . . . . . 0.661 ' H ' ' HZ3' ' B' ' 584' ' ' LYS . 7.1 m -118.2 147.29 43.53 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 121.834 0.826 . . . . 0.0 109.226 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 563' ' ' ALA . . . . . 0.759 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.94 -129.08 0.25 Allowed 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.563 0.697 . . . . 0.0 109.495 -178.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 564' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.7 mtp -65.66 26.3 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 565' ' ' ALA . . . . . 0.759 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.95 -9.07 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.3 163.14 23.14 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 567' ' ' LYS . . . . . 0.508 ' O ' ' CD1' ' B' ' 568' ' ' PHE . 18.6 mmmt -104.8 174.56 5.83 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 568' ' ' PHE . . . . . 0.508 ' CD1' ' O ' ' B' ' 567' ' ' LYS . 2.9 m-85 -159.81 132.01 6.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.526 -1.359 . . . . 0.0 110.219 -178.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 569' ' ' HIS . . . . . 0.543 ' ND1' ' CE1' ' B' ' 572' ' ' HIS . 9.0 m80 -53.3 113.4 4.68 Favored Pre-proline 0 C--N 1.305 -1.347 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 176.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 570' ' ' PRO . . . . . 0.602 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 31.2 Cg_exo -47.66 -13.26 0.17 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 CA-C-N 120.426 1.188 . . . . 0.0 110.802 -178.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 571' ' ' GLU . . . . . 0.537 ' N ' ' O ' ' B' ' 569' ' ' HIS . 5.9 mt-10 -92.22 -52.19 4.81 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 122.079 0.943 . . . . 0.0 110.359 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 572' ' ' HIS . . . . . 0.543 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -59.93 -5.67 1.06 Allowed 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.086 -1.009 . . . . 0.0 110.046 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 573' ' ' PHE . . . . . 0.43 ' H ' ' C ' ' B' ' 571' ' ' GLU . 36.4 t80 -127.72 56.01 1.6 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 574' ' ' VAL . . . . . . . . . . . . . 16.2 m -94.85 177.27 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.765 0.793 . . . . 0.0 111.448 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 575' ' ' CYS . . . . . 0.448 ' N ' ' HB2' ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.63 143.02 32.22 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 178.599 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.12 73.12 6.33 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 116.065 -2.254 . . . . 0.0 108.703 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 577' ' ' PHE . . . . . 0.416 ' O ' ' N ' ' A' ' 59' ' ' SER . 0.4 OUTLIER -157.52 -36.95 0.07 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 173.883 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 578' ' ' CYS . . . . . 0.584 ' O ' ' N ' ' B' ' 580' ' ' LYS . 29.8 p -137.12 82.43 1.93 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 178.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 579' ' ' LEU . . . . . 0.622 ' CD1' ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.46 13.96 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -176.493 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 580' ' ' LYS . . . . . 0.584 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -96.05 -38.3 10.26 Favored 'General case' 0 N--CA 1.505 2.323 0 CA-C-N 121.369 1.895 . . . . 0.0 113.024 -178.73 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 581' ' ' GLN . . . . . 0.602 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.6 tp60 -160.64 140.2 10.85 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 119.47 -2.019 . . . . 0.0 115.652 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 582' ' ' LEU . . . . . 0.448 ' HB2' ' N ' ' B' ' 575' ' ' CYS . 23.2 tp -135.07 170.1 16.42 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 583' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' B' ' 587' ' ' PHE . 79.2 m-20 -144.8 129.23 17.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.051 -1.031 . . . . 0.0 109.261 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 584' ' ' LYS . . . . . 0.661 ' HZ3' ' H ' ' B' ' 562' ' ' THR . 0.3 OUTLIER -53.85 -16.17 1.66 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.418 -0.801 . . . . 0.0 109.514 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.88 -17.76 53.07 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.8 p -135.63 28.94 3.26 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 587' ' ' PHE . . . . . 0.573 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 1.1 p90 -88.93 106.1 18.19 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 122.762 1.268 . . . . 0.0 109.738 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 588' ' ' LYS . . . . . 0.53 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.05 167.66 10.75 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 589' ' ' GLU . . . . . 0.445 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.7 tt0 -152.07 156.96 40.95 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 122.679 1.228 . . . . 0.0 110.593 -179.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 590' ' ' GLN . . . . . 0.562 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -158.59 146.47 18.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 591' ' ' ASN . . . . . 0.562 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 47.1 22.37 0.22 Allowed 'General case' 0 C--N 1.296 -1.746 0 O-C-N 121.008 -1.057 . . . . 0.0 109.906 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 81.07 -3.96 1.72 Allowed 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.664 -0.648 . . . . 0.0 111.149 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -89.6 123.57 66.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 O-C-N 121.116 -0.99 . . . . 0.0 109.125 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 594' ' ' PRO . . . . . 0.494 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 45.8 Cg_exo -48.26 165.44 0.15 Allowed 'Trans proline' 0 N--CA 1.485 1.026 0 CA-C-N 120.301 1.143 . . . . 0.0 110.923 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 595' ' ' TYR . . . . . 0.53 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.1 m-85 -170.3 141.1 1.97 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.734 -1.229 . . . . 0.0 111.204 -178.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 26.4 m -78.63 154.2 30.44 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 104.627 -2.36 . . . . 0.0 104.627 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 597' ' ' GLN . . . . . 0.478 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.44 -56.5 19.47 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -44.97 -33.85 2.19 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.63 0.729 . . . . 0.0 109.741 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 68.0 m -78.66 -62.85 1.56 Allowed 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.419 -0.801 . . . . 0.0 110.015 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 600' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -57.78 -47.57 82.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 122.102 -0.374 . . . . 0.0 111.937 -178.17 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 601' ' ' LEU . . . . . 0.523 ' CD2' ' N ' ' B' ' 602' ' ' LYS . 0.0 OUTLIER -56.28 -51.4 68.31 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 120.721 -1.237 . . . . 0.0 108.438 -177.892 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 602' ' ' LYS . . . . . 0.523 ' N ' ' CD2' ' B' ' 601' ' ' LEU . 18.5 tttt -45.56 -24.93 0.38 Allowed 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.389 -0.82 . . . . 0.0 109.972 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.91 -57.03 2.47 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.078 -1.014 . . . . 0.0 111.161 -178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 604' ' ' PHE . . . . . 0.501 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 37.8 m-85 -97.92 22.42 9.29 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.153 -0.967 . . . . 0.0 110.336 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 605' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 58.2 m . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.343 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.575 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -96.16 125.66 40.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.273 -1.134 . . . . 0.0 109.999 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.502 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -128.97 120.97 27.03 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 178.18 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.619 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.86 127.74 33.91 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.963 -1.086 . . . . 0.0 109.02 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.477 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.95 134.59 34.65 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -77.98 145.4 36.04 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.487 -0.885 . . . . 0.0 108.981 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.84 104.06 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-O 121.829 0.823 . . . . 0.0 109.909 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -79.66 104.5 10.3 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.587 HG13 ' CD2' ' A' ' 92' ' ' PHE . 3.6 t -74.76 118.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.047 -1.461 . . . . 0.0 109.114 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.3 p -85.32 -25.96 26.85 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.411 -0.806 . . . . 0.0 109.39 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -78.04 -8.16 57.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 108.702 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mt -130.3 -22.64 2.77 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' VAL . 31.3 t-20 75.47 12.56 3.16 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.427 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 74.9 mtp180 -95.32 -178.62 4.5 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.161 -0.962 . . . . 0.0 109.661 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 29' ' ' ARG . 72.4 m-20 -136.16 113.93 11.12 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 t -113.87 157.54 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-O 121.342 0.592 . . . . 0.0 109.489 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.446 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -128.51 135.99 50.18 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 32' ' ' THR . 3.1 mm? -115.34 113.55 23.95 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.777 -0.577 . . . . 0.0 109.743 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.575 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 9.0 tpt180 -60.25 105.6 0.43 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.9 m -134.18 -169.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.908 0.861 . . . . 0.0 110.591 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p -140.44 172.42 12.75 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.502 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -79.94 46.48 3.15 Favored Glycine 0 N--CA 1.485 1.903 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.442 ' C ' HG21 ' A' ' 78' ' ' THR . 4.9 pt-20 -149.75 4.31 0.57 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.675 -0.897 . . . . 0.0 108.928 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 78' ' ' THR . 3.1 m -87.02 137.29 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.945 -1.097 . . . . 0.0 109.959 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.463 ' O ' ' N ' ' A' ' 43' ' ' GLY . 4.2 m80 -79.73 147.83 31.76 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.042 -1.037 . . . . 0.0 108.656 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.442 ' C ' ' N ' ' A' ' 43' ' ' GLY . 59.5 mt -48.46 -52.56 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.126 -0.984 . . . . 0.0 109.381 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.64 -15.24 4.28 Favored Glycine 0 N--CA 1.484 1.857 0 N-CA-C 108.107 -1.997 . . . . 0.0 108.107 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -81.43 -28.32 44.4 Favored Glycine 0 N--CA 1.481 1.698 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.401 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.16 -55.29 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -1.126 . . . . 0.0 109.487 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -37.2 30.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.715 -1.24 . . . . 0.0 108.859 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.472 HD13 HD13 ' B' ' 603' ' ' LEU . 5.5 tp -57.52 -65.57 0.61 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.204 -0.935 . . . . 0.0 109.412 179.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -51.42 -59.46 4.21 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.409 -0.807 . . . . 0.0 111.523 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.919 HD23 ' HE2' ' A' ' 61' ' ' HIS . 25.1 tp -45.78 -46.07 15.08 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.091 -1.006 . . . . 0.0 109.83 -178.309 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.49 ' O ' ' N ' ' A' ' 52' ' ' LEU . 11.6 t -67.21 -48.38 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.032 -1.043 . . . . 0.0 108.826 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -45.04 -40.42 6.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.354 -0.841 . . . . 0.0 109.683 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -66.74 -31.9 72.86 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.349 -0.844 . . . . 0.0 108.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 49' ' ' VAL . 3.7 tp -67.7 -66.55 0.55 Allowed 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 t70 64.42 75.89 0.36 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.747 0.784 . . . . 0.0 110.051 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.545 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.5 p -173.07 152.55 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 C-N-CA 120.186 -0.605 . . . . 0.0 109.799 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -71.01 37.52 0.05 Allowed 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' ' 54' ' ' VAL . 19.2 tttp -77.97 179.97 6.44 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.082 -1.011 . . . . 0.0 109.237 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.521 ' N ' ' OD2' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -60.13 92.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.312 -0.867 . . . . 0.0 110.223 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.454 ' CE2' HG13 ' A' ' 49' ' ' VAL . 16.4 m0 -91.07 -35.98 14.29 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.253 -0.904 . . . . 0.0 109.511 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.559 ' C ' ' H ' ' A' ' 61' ' ' HIS . 3.7 t -73.99 -34.37 64.18 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.967 -1.083 . . . . 0.0 108.838 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -71.88 19.27 0.07 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.919 ' HE2' HD23 ' A' ' 48' ' ' LEU . 5.7 t-80 -105.65 130.43 53.68 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 122.024 0.916 . . . . 0.0 111.864 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 93' ' ' THR . . . -170.02 145.19 2.84 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.797 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.1 mm? -94.93 143.03 26.8 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.771 -1.206 . . . . 0.0 110.363 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.522 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.73 150.03 49.97 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.31 93.61 4.6 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.029 -1.044 . . . . 0.0 108.725 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -55.21 -23.73 23.73 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 111.058 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.528 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.2 mmtp -69.23 -8.89 49.99 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 178.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.6 mmtt -133.32 -12.43 2.77 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.731 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.39 46.21 27.09 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -178.148 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -112.43 -172.93 2.14 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.362 0.601 . . . . 0.0 109.868 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.557 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.04 98.66 5.2 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 177.424 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.402 ' HB3' HD13 ' A' ' 41' ' ' ILE . 29.0 mt -60.34 91.01 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 122.618 1.199 . . . . 0.0 109.984 -177.083 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 71' ' ' TRP . 1.9 pp -123.64 14.55 9.44 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.605 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -90.44 72.36 6.98 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.275 -0.891 . . . . 0.0 109.332 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.529 HG21 ' O ' ' B' ' 602' ' ' LYS . 3.1 m -62.38 -13.67 31.9 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.978 -1.076 . . . . 0.0 110.002 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.69 -50.91 15.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.102 -0.999 . . . . 0.0 109.767 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -172.14 1.65 Allowed 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.712 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -137.73 -164.92 1.69 Allowed 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.626 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.572 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.0 mp -69.72 -59.63 2.83 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -46.91 -51.99 15.53 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.137 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.712 ' CG ' ' H ' ' A' ' 78' ' ' THR . 33.8 mmtt -44.91 -55.01 5.84 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.542 0.687 . . . . 0.0 109.966 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.23 -40.22 59.25 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.136 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.88 7.01 8.91 Favored Glycine 0 N--CA 1.5 2.95 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.499 HG22 ' N ' ' A' ' 85' ' ' GLN . 52.8 mt -62.0 160.86 2.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.45 -1.029 . . . . 0.0 109.386 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.499 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.7 tp60 -171.92 -163.47 0.26 Allowed 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.1 62.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.88 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -75.12 -9.93 59.0 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.68 113.64 26.22 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -94.46 116.53 28.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.985 -1.072 . . . . 0.0 109.524 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.443 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.1 mt -94.81 176.79 6.13 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.444 0.64 . . . . 0.0 109.296 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.522 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.8 mt-30 -132.35 159.25 39.74 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -115.89 94.2 4.58 Favored 'General case' 0 N--CA 1.503 2.183 0 CA-C-O 122.484 1.135 . . . . 0.0 108.023 179.237 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.439 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.542 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.488 1.462 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.25 135.75 57.82 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 120.855 -1.153 . . . . 0.0 110.315 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.479 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.81 103.9 13.46 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.317 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.5 t -51.21 127.05 18.34 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 122.191 0.996 . . . . 0.0 109.59 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.67 -34.59 5.39 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 106.161 -2.776 . . . . 0.0 106.161 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.85 -35.57 7.29 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.02 56.37 6.67 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.699 1.237 . . . . 0.0 109.957 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -140.64 123.78 10.06 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -44.21 135.38 8.54 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 CA-C-N 120.489 1.21 . . . . 0.0 114.604 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.1 mt -93.4 98.34 8.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 557' ' ' THR . . . . . 0.424 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.3 p -99.38 91.57 5.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.246 -0.909 . . . . 0.0 111.223 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.6 -95.26 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.481 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -114.76 152.33 32.26 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 177.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.6 126.53 15.4 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.932 -1.105 . . . . 0.0 111.541 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.9 mt -91.01 146.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 7.9 m -118.48 146.94 44.11 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-O 121.79 0.805 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.53 -129.39 0.26 Allowed 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.604 0.716 . . . . 0.0 109.331 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.554 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.3 mtt -65.78 26.34 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.01 -8.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.73 161.0 23.5 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.73 174.29 5.94 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -160.2 136.34 8.64 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.233 -1.387 . . . . 0.0 109.861 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.572 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.61 114.99 8.3 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.442 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 47.1 Cg_exo -45.69 -12.44 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 CA-C-N 120.316 1.148 . . . . 0.0 111.449 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.857 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.9 mt-10 -96.51 -52.73 3.84 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 122.001 0.905 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.517 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 19.1 m170 -57.61 -4.29 0.25 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.897 -1.127 . . . . 0.0 109.886 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.444 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.7 t80 -127.34 55.04 1.62 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.857 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.48 177.73 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.802 0.81 . . . . 0.0 111.116 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.638 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.19 143.42 29.63 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.408 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 576' ' ' ALA . . . . . 0.453 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -92.98 75.56 4.76 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 116.769 -1.972 . . . . 0.0 109.589 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -153.29 -54.51 0.11 Allowed 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 102.599 -3.112 . . . . 0.0 102.599 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.529 ' O ' ' N ' ' B' ' 580' ' ' LYS . 23.8 p -127.57 78.89 1.85 Allowed 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 111.567 -2.561 . . . . 0.0 104.253 177.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.5 mt -53.14 15.55 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.84 -37.13 18.03 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 119.735 -1.853 . . . . 0.0 112.122 -178.794 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.433 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.3 tp-100 -159.65 140.89 12.69 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 119.636 -1.915 . . . . 0.0 114.466 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.638 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.0 tp -136.34 170.68 15.64 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.434 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.2 m-20 -144.94 128.47 17.03 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.277 -0.89 . . . . 0.0 109.143 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -15.99 0.8 Allowed 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.43 -0.794 . . . . 0.0 109.625 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.17 -21.05 50.98 Favored Glycine 0 N--CA 1.485 1.91 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -133.73 28.91 3.89 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.576 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.7 OUTLIER -89.94 108.98 20.04 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.489 1.137 . . . . 0.0 110.115 -179.692 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.5 160.0 14.81 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.8 tt0 -154.82 157.0 37.24 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 122.584 1.183 . . . . 0.0 111.115 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.435 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 21.3 pt20 -156.65 146.04 20.57 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 177.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.534 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.88 23.8 0.74 Allowed 'General case' 0 C--N 1.289 -2.048 0 O-C-N 121.29 -0.881 . . . . 0.0 109.465 -178.656 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.6 m-20 82.93 -7.06 1.23 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.791 -0.568 . . . . 0.0 111.661 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.7 mttm -86.01 116.22 64.87 Favored Pre-proline 0 C--N 1.293 -1.867 0 O-C-N 121.042 -1.036 . . . . 0.0 110.723 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.471 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.4 Cg_exo -52.57 162.84 2.09 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 CA-C-N 119.919 1.007 . . . . 0.0 112.328 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.471 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 20.1 m-85 -171.27 143.63 1.9 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.247 -0.908 . . . . 0.0 110.289 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.4 m -75.29 153.87 37.7 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 173.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -56.97 -57.13 13.87 Favored 'General case' 0 C--N 1.289 -2.036 0 C-N-CA 117.475 -1.69 . . . . 0.0 106.813 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.27 -28.77 1.38 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.48 -0.763 . . . . 0.0 109.6 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 80.1 m -82.76 -61.08 1.97 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.312 -0.867 . . . . 0.0 109.039 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.45 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 1.1 t80 -55.45 -55.33 32.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.535 -0.728 . . . . 0.0 109.582 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.689 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.21 -42.83 31.16 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.209 -0.932 . . . . 0.0 109.14 -178.939 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.529 ' O ' HG21 ' A' ' 75' ' ' THR . 25.7 tptt -56.34 -23.85 40.01 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.215 -0.928 . . . . 0.0 110.002 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.472 HD13 HD13 ' A' ' 46' ' ' LEU . 4.6 mt -89.16 -56.9 3.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.921 -1.112 . . . . 0.0 111.303 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.496 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 16.7 m-85 -109.99 -25.72 10.11 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.262 -0.899 . . . . 0.0 110.59 -178.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.496 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.0 p . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.056 -1.028 . . . . 0.0 109.949 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.459 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 108.51 -1.836 . . . . 0.0 108.51 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.499 HG23 ' O ' ' A' ' 17' ' ' THR . 6.7 t -90.18 123.23 33.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.57 -0.959 . . . . 0.0 109.907 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.475 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -134.61 123.33 23.63 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.94 130.12 37.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.135 -0.978 . . . . 0.0 109.136 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.46 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.09 134.27 34.61 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.74 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -78.14 145.74 35.5 Favored 'General case' 0 C--N 1.297 -1.694 0 O-C-N 121.296 -0.877 . . . . 0.0 109.77 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 36.7 t -136.73 105.37 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.926 0.87 . . . . 0.0 109.767 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -78.72 104.86 9.62 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.549 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -71.95 100.61 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 O-C-N 121.336 -0.852 . . . . 0.0 110.077 -178.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.556 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -76.07 177.0 7.44 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 178.83 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.9 t70 56.8 6.57 0.31 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.727 -1.233 . . . . 0.0 107.918 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.556 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.8 mt -149.27 -37.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 24' ' ' VAL . 24.8 t-20 77.25 15.97 1.72 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.521 178.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -91.17 -178.97 5.31 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.613 -1.304 . . . . 0.0 108.635 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -140.74 116.93 10.6 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.431 HG12 ' N ' ' A' ' 32' ' ' THR . 23.1 t -119.02 157.43 20.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-O 121.56 0.695 . . . . 0.0 109.792 -178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.501 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.43 134.6 43.81 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.626 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.501 HD22 ' C ' ' A' ' 32' ' ' THR . 3.8 mm? -114.3 114.13 25.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.6 -0.687 . . . . 0.0 109.398 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.471 ' HE ' ' HB3' ' A' ' 19' ' ' GLU . 1.3 tpp85 -57.84 108.52 0.59 Allowed 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.7 m -137.45 -169.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 122.062 0.934 . . . . 0.0 110.352 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -141.81 174.42 10.59 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.475 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -81.48 47.29 3.59 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.419 ' C ' HG21 ' A' ' 78' ' ' THR . 6.0 pt-20 -150.77 4.33 0.49 Allowed 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.737 -0.861 . . . . 0.0 108.994 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.508 ' O ' HG22 ' A' ' 78' ' ' THR . 2.5 m -86.01 143.35 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 120.914 -1.116 . . . . 0.0 109.846 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.503 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -78.56 146.36 34.3 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 179.446 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.465 ' C ' ' N ' ' A' ' 43' ' ' GLY . 97.3 mt -49.57 -56.33 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.053 -1.029 . . . . 0.0 108.828 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.626 ' H ' HG23 ' A' ' 75' ' ' THR . . . -56.45 -9.56 3.47 Favored Glycine 0 N--CA 1.485 1.912 0 N-CA-C 108.089 -2.004 . . . . 0.0 108.089 179.279 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.73 -28.0 66.01 Favored Glycine 0 N--CA 1.484 1.878 0 N-CA-C 107.611 -2.196 . . . . 0.0 107.611 178.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.38 -41.41 16.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 41.5 mtm -48.43 -36.67 15.35 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -71.57 -66.03 0.68 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.391 0.615 . . . . 0.0 110.096 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CB ' HD12 ' A' ' 33' ' ' LEU . 47.0 mttm -53.37 -55.78 22.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.306 -0.871 . . . . 0.0 110.666 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -45.83 -58.45 3.5 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.924 -1.11 . . . . 0.0 109.004 -179.254 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.513 ' O ' ' N ' ' A' ' 52' ' ' LEU . 73.2 t -57.29 -48.26 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.752 -0.592 . . . . 0.0 110.25 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -44.7 -40.04 5.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.081 -1.012 . . . . 0.0 109.512 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.508 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -70.7 -26.37 63.38 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.457 -0.777 . . . . 0.0 109.446 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.6 tp -80.04 -75.05 0.27 Allowed 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.338 -0.851 . . . . 0.0 108.801 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 t70 71.4 83.13 0.14 Allowed 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.835 0.826 . . . . 0.0 110.6 178.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.576 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -170.26 151.84 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.0 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.354 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.46 30.71 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 109.379 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.576 ' H ' ' C ' ' A' ' 54' ' ' VAL . 49.7 tttm -77.73 171.58 14.73 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.011 -1.055 . . . . 0.0 108.413 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.497 ' N ' ' OD1' ' A' ' 57' ' ' ASP . 0.6 OUTLIER -92.67 90.7 7.2 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 120.974 -1.079 . . . . 0.0 109.509 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.448 ' O ' ' O ' ' A' ' 61' ' ' HIS . 2.3 m0 -76.59 -51.56 11.4 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.177 -0.952 . . . . 0.0 108.529 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.8 p -41.51 -56.14 2.63 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.312 0.577 . . . . 0.0 110.406 -178.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -52.25 -40.5 61.78 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' O ' ' A' ' 58' ' ' TRP . 16.0 m170 -85.0 123.13 30.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.81 0.814 . . . . 0.0 110.324 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.16 -179.98 5.66 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.836 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.29 143.03 26.74 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.868 -1.145 . . . . 0.0 109.857 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.536 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -130.34 151.7 50.56 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.264 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -110.62 94.55 5.06 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.104 -0.998 . . . . 0.0 108.641 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.418 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 8.5 pt-20 -56.12 -23.55 35.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.245 -0.91 . . . . 0.0 110.813 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.536 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.7 mmtp -68.43 -9.64 49.94 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.1 mmtt -133.1 -12.17 2.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.915 -178.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.67 46.15 27.27 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -178.151 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -113.61 -173.5 2.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.612 0.72 . . . . 0.0 110.126 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.57 102.44 7.37 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.411 ' HB3' HD13 ' A' ' 41' ' ' ILE . 35.6 mt -61.9 86.57 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.325 0 O-C-N 120.504 -1.373 . . . . 0.0 110.548 -176.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.2 pp -120.99 10.88 10.89 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -87.07 36.33 0.73 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.626 HG23 ' H ' ' A' ' 42' ' ' GLY . 21.6 m -46.01 -14.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.223 -0.923 . . . . 0.0 110.058 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 8.4 m80 -62.63 -29.03 70.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.136 -0.977 . . . . 0.0 109.249 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 77.1 m95 -104.17 -155.26 0.53 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.438 -0.789 . . . . 0.0 109.406 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.672 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -144.44 171.29 14.56 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.165 0.983 . . . . 0.0 109.386 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.561 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 7.7 mp -48.11 -62.34 1.52 Allowed 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.127 0.965 . . . . 0.0 108.515 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -45.94 -52.01 12.33 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.874 0.845 . . . . 0.0 110.085 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.672 ' CG ' ' H ' ' A' ' 78' ' ' THR . 31.7 mmtt -45.13 -55.58 5.57 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 121.552 0.691 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.09 -41.86 63.61 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.979 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 121.65 7.08 8.3 Favored Glycine 0 N--CA 1.499 2.89 0 N-CA-C 108.844 -1.703 . . . . 0.0 108.844 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 85' ' ' GLN . 50.5 mt -62.33 161.04 2.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.486 -1.008 . . . . 0.0 109.282 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.485 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.6 tp60 -171.18 -164.63 0.36 Allowed 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.0 -24.29 62.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.403 -0.811 . . . . 0.0 109.694 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 88' ' ' ALA . 28.1 p30 -76.26 -11.46 59.92 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.267 -0.896 . . . . 0.0 108.67 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.456 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.55 113.52 25.97 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -94.46 117.14 29.67 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.106 -0.996 . . . . 0.0 109.773 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.46 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.5 mt -93.84 176.52 6.32 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.466 0.65 . . . . 0.0 109.25 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.536 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.6 mt-30 -133.34 167.73 19.88 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.441 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 25.0 t80 -124.01 99.0 6.04 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.12 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.154 0 O-C-N 121.356 -0.84 . . . . 0.0 111.037 -176.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.06 135.17 57.63 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 120.811 -1.181 . . . . 0.0 110.513 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.49 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.69 104.15 13.57 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.22 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.1 t -51.46 127.19 19.32 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.24 1.019 . . . . 0.0 109.674 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.7 -34.54 5.41 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 10.8 m -105.75 -35.97 7.2 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.3 56.4 6.44 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.682 1.23 . . . . 0.0 109.997 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -140.79 124.08 10.07 Favored Pre-proline 0 C--N 1.294 -1.815 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -44.14 135.15 8.45 Favored 'Trans proline' 0 N--CA 1.491 1.376 0 CA-C-N 120.433 1.19 . . . . 0.0 114.842 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.0 mt -93.83 98.41 8.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.2 p -98.97 91.34 4.99 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.191 -0.943 . . . . 0.0 111.349 -177.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.0 -96.76 0.16 Allowed Glycine 0 N--CA 1.487 2.07 0 N-CA-C 107.579 -2.209 . . . . 0.0 107.579 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.486 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.2 mmt-85 -111.77 151.95 28.4 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 23.7 p -144.57 126.45 15.35 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.902 -1.124 . . . . 0.0 111.512 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 44.8 mt -90.75 146.06 6.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.466 ' H ' ' HD2' ' B' ' 584' ' ' LYS . 8.8 m -118.8 146.53 44.75 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.847 0.832 . . . . 0.0 109.009 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.739 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -129.29 0.26 Allowed 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.598 0.713 . . . . 0.0 109.287 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 3.1 mtt -66.29 26.69 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.739 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.27 -9.06 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.63 159.41 24.03 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 567' ' ' LYS . . . . . 0.404 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 16.9 mmmt -102.55 174.67 5.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 568' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 2.5 m-85 -160.29 132.85 6.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.236 -1.386 . . . . 0.0 110.225 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.537 ' ND1' ' ND1' ' B' ' 572' ' ' HIS . 9.6 m80 -53.88 113.81 5.51 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.447 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.88 -12.53 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.535 0 CA-C-N 120.458 1.199 . . . . 0.0 110.731 -178.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.877 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.5 mt-10 -91.86 -51.81 5.04 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 122.076 0.941 . . . . 0.0 110.243 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.537 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -61.48 -3.22 0.92 Allowed 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.168 -0.957 . . . . 0.0 109.896 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.409 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.1 t80 -132.19 59.21 1.72 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.877 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.9 m -94.59 177.76 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.931 0.872 . . . . 0.0 111.518 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.666 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.92 145.52 27.73 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.505 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.64 76.22 3.26 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 116.843 -1.943 . . . . 0.0 109.844 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -152.68 -52.48 0.11 Allowed 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 102.191 -3.263 . . . . 0.0 102.191 173.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.0 p -129.63 80.11 1.94 Allowed 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 111.437 -2.62 . . . . 0.0 104.47 176.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mt -52.43 16.11 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.836 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.52 -36.87 17.37 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 119.632 -1.917 . . . . 0.0 112.551 -178.673 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.447 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -159.05 140.14 12.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 119.611 -1.93 . . . . 0.0 114.653 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.666 HD13 ' HB2' ' B' ' 575' ' ' CYS . 22.2 tp -137.11 169.54 17.6 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.144 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.1 m-20 -147.09 131.24 17.35 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.313 -0.867 . . . . 0.0 109.229 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.466 ' HD2' ' H ' ' B' ' 562' ' ' THR . 14.6 ptmt -52.58 -21.89 4.37 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.443 -0.785 . . . . 0.0 109.476 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.64 -17.31 64.13 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -179.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.64 26.95 3.38 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.82 108.51 19.74 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 122.729 1.252 . . . . 0.0 110.06 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.531 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.99 167.88 9.55 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.424 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.5 tt0 -153.15 156.3 38.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.808 -1.183 . . . . 0.0 110.373 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.424 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 7.8 tt0 -157.96 146.68 19.21 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 178.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.519 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 50.08 21.99 0.84 Allowed 'General case' 0 C--N 1.29 -1.997 0 O-C-N 121.182 -0.949 . . . . 0.0 109.26 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.1 m-20 81.2 -4.99 1.66 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.786 -0.571 . . . . 0.0 110.716 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 593' ' ' LYS . . . . . 0.412 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 33.4 mttm -91.36 118.98 68.77 Favored Pre-proline 0 C--N 1.295 -1.795 0 O-C-N 121.258 -0.901 . . . . 0.0 109.575 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.0 Cg_exo -49.23 166.44 0.18 Allowed 'Trans proline' 0 N--CA 1.488 1.171 0 CA-C-N 120.135 1.084 . . . . 0.0 111.494 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' B' ' 588' ' ' LYS . 21.9 m-85 -170.55 137.3 1.36 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.08 -1.012 . . . . 0.0 110.756 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 16.3 m -69.55 154.28 42.23 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 173.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -58.81 -56.68 19.04 Favored 'General case' 0 C--N 1.289 -2.046 0 C-N-CA 117.479 -1.689 . . . . 0.0 106.459 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -45.53 -26.53 0.6 Allowed 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.587 -0.696 . . . . 0.0 109.845 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 93.4 m -84.48 -65.4 1.01 Allowed 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.155 -0.965 . . . . 0.0 109.31 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 600' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -51.27 -56.66 11.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.497 -0.752 . . . . 0.0 109.38 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.688 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.31 -42.47 31.12 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.262 -0.898 . . . . 0.0 109.064 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.405 ' O ' HG21 ' A' ' 75' ' ' THR . 24.1 tptp -58.8 -20.27 48.64 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.366 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.87 -56.44 3.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.751 -1.218 . . . . 0.0 110.779 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.41 ' O ' ' C ' ' B' ' 605' ' ' CYS . 9.5 m-85 -107.43 32.35 4.74 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.414 -0.804 . . . . 0.0 109.924 -178.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.41 ' C ' ' O ' ' B' ' 604' ' ' PHE . 9.4 t . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.924 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 108.804 -1.718 . . . . 0.0 108.804 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -95.7 122.53 38.56 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.471 -1.017 . . . . 0.0 109.802 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.609 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -131.27 120.93 23.89 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.26 129.37 35.81 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.162 -0.961 . . . . 0.0 109.215 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.474 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.79 134.42 34.73 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.183 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.22 146.24 35.05 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.272 -0.893 . . . . 0.0 109.794 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -138.51 105.44 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 CA-C-O 121.786 0.803 . . . . 0.0 110.059 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.494 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 2.8 m80 -79.59 104.75 10.41 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -71.11 98.21 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.258 -0.901 . . . . 0.0 109.915 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.502 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -70.03 164.28 24.34 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.9 t70 72.09 -43.65 0.57 Allowed 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 25' ' ' THR . 4.8 mt -93.25 -30.77 15.01 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.565 ' N ' ' O ' ' A' ' 24' ' ' VAL . 27.7 t-20 73.31 17.45 3.93 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.085 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtp85 -94.27 -178.73 4.7 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.899 -1.126 . . . . 0.0 109.142 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.494 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 9.9 m-20 -140.18 117.8 11.57 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG12 ' N ' ' A' ' 32' ' ' THR . 20.1 t -120.7 157.76 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.653 0.739 . . . . 0.0 110.013 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.463 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.06 135.36 45.3 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.463 HD22 ' C ' ' A' ' 32' ' ' THR . 3.7 mm? -113.53 111.59 22.15 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.511 -0.743 . . . . 0.0 109.322 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -61.11 102.45 0.21 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.9 m -129.95 -169.16 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 CA-C-O 121.936 0.874 . . . . 0.0 109.969 -178.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.7 p -139.32 169.59 17.49 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.609 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -77.13 44.66 2.17 Favored Glycine 0 N--CA 1.485 1.943 0 C-N-CA 119.386 -1.387 . . . . 0.0 109.634 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.486 ' C ' HG21 ' A' ' 78' ' ' THR . 3.9 pt-20 -146.61 4.04 0.87 Allowed 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.608 -0.936 . . . . 0.0 108.795 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -88.17 137.19 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.67 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.8 m80 -76.1 146.78 39.08 Favored 'General case' 0 C--N 1.293 -1.865 0 O-C-N 120.942 -1.099 . . . . 0.0 108.689 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.409 ' C ' ' N ' ' A' ' 43' ' ' GLY . 97.7 mt -45.93 -58.64 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.964 . . . . 0.0 109.583 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.506 ' H ' HG22 ' A' ' 75' ' ' THR . . . -54.8 -16.82 8.08 Favored Glycine 0 C--N 1.297 -1.602 0 N-CA-C 108.496 -1.841 . . . . 0.0 108.496 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -69.34 -29.17 71.94 Favored Glycine 0 N--CA 1.483 1.772 0 N-CA-C 107.941 -2.063 . . . . 0.0 107.941 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 t -84.79 -39.81 14.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.49 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.0 mtm -46.68 -37.67 8.68 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.764 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -78.22 -56.94 4.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.711 -0.618 . . . . 0.0 110.641 -178.514 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -53.03 -59.85 4.03 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.794 -1.191 . . . . 0.0 110.738 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.68 -44.92 13.84 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.153 -0.967 . . . . 0.0 109.364 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.423 HG13 ' CE2' ' A' ' 58' ' ' TRP . 39.9 t -68.27 -48.01 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.514 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -45.08 -39.24 5.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 0.0 109.866 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.54 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 8.7 mtmp? -75.93 -28.38 57.98 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.347 -0.846 . . . . 0.0 110.447 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.416 HD23 ' HE1' ' A' ' 58' ' ' TRP . 11.1 tp -60.99 -65.93 0.61 Allowed 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.084 -1.01 . . . . 0.0 108.878 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.2 t70 75.53 77.95 0.1 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.909 0.862 . . . . 0.0 110.422 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.557 ' O ' ' N ' ' A' ' 56' ' ' LYS . 3.0 p -175.05 126.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.007 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.477 ' HG3' HD12 ' B' ' 579' ' ' LEU . 18.1 tptt -65.0 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 109.873 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.557 ' N ' ' O ' ' A' ' 54' ' ' VAL . 4.5 ttpm? -77.66 161.23 27.94 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.041 -1.037 . . . . 0.0 108.701 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.418 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -66.71 93.37 0.25 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.296 -0.877 . . . . 0.0 109.38 -179.557 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.528 ' CZ2' ' O ' ' A' ' 54' ' ' VAL . 16.7 m0 -83.77 -46.49 12.17 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.839 0.828 . . . . 0.0 109.029 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.8 m -42.69 -55.19 3.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.299 -0.876 . . . . 0.0 110.47 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -50.5 -23.35 2.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.407 -0.808 . . . . 0.0 110.215 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.467 ' CB ' ' CZ ' ' A' ' 92' ' ' PHE . 21.9 m-70 -90.89 160.05 15.9 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.998 -1.064 . . . . 0.0 111.864 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.26 170.56 13.07 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.812 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -94.36 146.23 24.2 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.6 -1.313 . . . . 0.0 110.07 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.577 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -129.86 151.57 50.29 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.07 93.77 4.65 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.108 -0.995 . . . . 0.0 108.782 -179.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -55.48 -23.83 27.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.29 -0.881 . . . . 0.0 110.771 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.514 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.9 mmtp -67.51 -10.14 48.86 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 178.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -133.48 -12.04 2.74 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.984 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.5 mpp_? 52.28 46.18 27.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 -178.088 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -114.01 -171.15 1.85 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.607 0.717 . . . . 0.0 110.071 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.452 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -126.1 103.64 7.82 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 177.357 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.02 86.84 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.27 0 O-C-N 120.507 -1.371 . . . . 0.0 111.15 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.37 9.31 10.32 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.451 ' C ' ' H ' ' A' ' 76' ' ' HIS . 5.6 mmpt? -77.65 54.18 1.18 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.679 -0.638 . . . . 0.0 110.029 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.506 HG22 ' H ' ' A' ' 42' ' ' GLY . 6.1 p -59.13 -5.99 0.79 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.864 -1.147 . . . . 0.0 108.769 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.451 ' H ' ' C ' ' A' ' 74' ' ' LYS . 36.1 m80 -59.41 -40.78 87.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.519 -0.738 . . . . 0.0 110.971 -179.211 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -121.18 -162.46 0.97 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.608 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -120.24 -164.17 1.07 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.973 -1.079 . . . . 0.0 110.481 -178.257 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.631 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.1 mp -71.63 -59.26 2.85 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -47.01 -52.67 14.26 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.018 0.914 . . . . 0.0 109.72 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.608 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.4 mmtt -45.31 -55.06 6.33 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.674 0.75 . . . . 0.0 109.664 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -71.35 -43.62 66.61 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.256 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.37 4.21 8.38 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 108.819 -1.713 . . . . 0.0 108.819 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.518 HG22 ' N ' ' A' ' 85' ' ' GLN . 38.4 mt -61.69 161.05 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 O-C-N 121.582 -0.952 . . . . 0.0 109.35 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.518 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.7 tp60 -172.13 -161.96 0.19 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.361 -0.837 . . . . 0.0 109.143 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.83 -23.98 60.84 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.504 -0.748 . . . . 0.0 109.482 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -74.5 -11.92 60.35 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.474 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.46 113.15 25.34 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.9 mmtp -94.78 118.12 31.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.911 -1.118 . . . . 0.0 109.69 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HG ' HD12 ' A' ' 20' ' ' LEU . 11.0 mt -94.41 175.99 6.47 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.561 0.696 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.577 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -134.87 161.38 35.4 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 61.8 t80 -120.42 91.23 3.49 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.507 2.386 0 O-C-N 121.848 -0.533 . . . . 0.0 110.291 -177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.533 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m . . . . . 0 N--CA 1.487 1.395 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -58.13 134.4 56.43 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 120.942 -1.099 . . . . 0.0 110.713 -178.005 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.504 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.1 OUTLIER -82.8 104.0 12.71 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.866 -1.901 . . . . 0.0 105.866 178.206 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.0 t -48.7 124.75 8.86 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 122.034 0.921 . . . . 0.0 109.318 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 110.23 -37.21 3.86 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.8 m -101.86 -35.99 8.82 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.35 56.41 6.4 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.815 1.293 . . . . 0.0 109.427 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -140.45 122.44 9.61 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.23 133.46 9.02 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 CA-C-N 120.539 1.228 . . . . 0.0 114.504 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.533 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -92.04 98.15 8.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.66 91.14 4.73 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.992 0.901 . . . . 0.0 111.238 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.07 -96.36 0.15 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 107.283 -2.327 . . . . 0.0 107.283 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.475 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.8 mmt-85 -112.39 149.86 31.92 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -145.04 126.64 15.11 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.911 -1.118 . . . . 0.0 111.521 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 43.0 mt -91.4 146.41 6.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.6 m -120.13 146.39 46.01 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.873 0.844 . . . . 0.0 108.945 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.716 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.74 -129.22 0.26 Allowed 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.551 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.88 25.94 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 109.245 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.716 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.99 -8.13 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -178.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 150.63 28.11 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 567' ' ' LYS . . . . . 0.414 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 18.2 mmmt -96.49 174.72 6.71 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 568' ' ' PHE . . . . . 0.414 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 0.9 OUTLIER -162.27 132.07 4.58 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 117.568 -1.653 . . . . 0.0 111.31 -178.607 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.592 ' O ' ' N ' ' B' ' 571' ' ' GLU . 2.6 m80 -50.59 112.27 2.76 Favored Pre-proline 0 C--N 1.297 -1.687 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 176.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.431 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 51.1 Cg_exo -44.62 -4.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.415 0 CA-C-N 120.186 1.102 . . . . 0.0 114.395 -178.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.967 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.8 mt-10 -112.16 -53.66 2.69 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 122.749 1.261 . . . . 0.0 108.814 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -46.78 -15.15 0.03 OUTLIER 'General case' 0 C--N 1.285 -2.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.453 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.519 ' N ' ' O ' ' B' ' 571' ' ' GLU . 55.1 t80 -118.53 54.08 0.96 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.967 HG13 ' O ' ' B' ' 571' ' ' GLU . 14.1 m -91.83 176.13 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.593 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -71.39 141.2 50.35 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 576' ' ' ALA . . . . . 0.49 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.87 74.88 6.48 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 116.377 -2.129 . . . . 0.0 108.486 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -150.85 -60.58 0.18 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 100.839 -3.763 . . . . 0.0 100.839 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.6 OUTLIER -104.8 155.28 19.04 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 176.156 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 1.066 ' H ' HD22 ' B' ' 579' ' ' LEU . 0.0 OUTLIER -105.55 14.21 28.88 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.033 -1.042 . . . . 0.0 111.265 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.573 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -102.86 -38.99 7.16 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.415 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.4 tp-100 -162.42 142.0 9.46 Favored 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 122.447 2.385 . . . . 0.0 115.979 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.593 HD13 ' HB2' ' B' ' 575' ' ' CYS . 22.7 tp -137.41 168.4 19.72 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 174.424 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.8 m-20 -150.54 133.85 16.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.859 -1.15 . . . . 0.0 109.843 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -50.39 -18.85 0.7 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.563 0.697 . . . . 0.0 109.697 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.76 -21.26 51.33 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 586' ' ' THR . . . . . 0.449 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.5 p -134.62 26.79 3.71 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.58 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.65 108.37 19.77 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 122.589 1.185 . . . . 0.0 110.256 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.49 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.73 169.85 8.37 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.063 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.422 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.7 tt0 -151.34 157.19 42.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.653 -1.279 . . . . 0.0 110.832 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.481 ' OE1' ' CD1' ' B' ' 604' ' ' PHE . 3.0 tp60 -153.22 146.07 24.42 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.487 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.3 OUTLIER 45.03 23.54 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.057 -1.027 . . . . 0.0 110.064 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.487 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.2 m-20 82.66 -4.82 1.35 Allowed 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.811 -0.556 . . . . 0.0 110.702 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 39.1 mttm -91.57 124.54 60.54 Favored Pre-proline 0 C--N 1.295 -1.787 0 O-C-N 121.302 -0.874 . . . . 0.0 109.698 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.492 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.8 Cg_exo -49.09 163.64 0.32 Allowed 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 119.971 1.025 . . . . 0.0 112.479 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.499 ' OH ' HD21 ' A' ' 46' ' ' LEU . 13.5 m-85 -170.73 141.69 1.86 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.335 -0.853 . . . . 0.0 109.796 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 596' ' ' CYS . . . . . 0.468 ' SG ' ' CB ' ' B' ' 575' ' ' CYS . 6.0 m -74.49 157.05 36.23 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -60.83 -57.31 13.21 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.56 -30.18 2.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.454 -0.778 . . . . 0.0 108.936 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 8.6 m -79.43 -62.56 1.65 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.545 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.3 OUTLIER -56.73 -55.96 27.51 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-O 121.15 0.5 . . . . 0.0 110.585 -179.685 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.637 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -47.66 -42.16 23.96 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.228 -0.92 . . . . 0.0 109.091 -178.566 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.472 ' O ' HG21 ' A' ' 75' ' ' THR . 28.3 tttt -59.67 -20.9 59.27 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.187 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.764 HD13 HD12 ' A' ' 46' ' ' LEU . 6.6 mt -90.6 -56.74 3.08 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.131 -0.98 . . . . 0.0 111.509 -178.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.481 ' CD1' ' OE1' ' B' ' 590' ' ' GLN . 4.2 m-85 -89.37 30.64 0.97 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.874 -1.141 . . . . 0.0 110.396 -178.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.503 ' SG ' ' O ' ' B' ' 601' ' ' LEU . 3.2 m . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.912 -1.117 . . . . 0.0 109.291 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.486 2.028 0 N-CA-C 108.168 -1.973 . . . . 0.0 108.168 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.675 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 12.4 p -79.45 129.62 34.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.481 -1.011 . . . . 0.0 109.648 -179.34 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.548 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -153.04 137.67 16.88 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.589 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -90.38 132.3 35.68 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.014 -1.053 . . . . 0.0 110.1 -179.575 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.524 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.42 134.2 34.48 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.92 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.27 145.73 35.25 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.169 -0.957 . . . . 0.0 108.69 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.2 t -138.51 106.7 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-O 121.78 0.8 . . . . 0.0 110.193 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.521 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 16.4 m170 -82.11 103.97 12.11 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.543 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -73.97 108.61 5.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 118.654 -1.219 . . . . 0.0 108.22 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.89 -23.46 38.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 109.057 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -78.84 -8.33 58.71 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.1 mt -130.15 -21.06 2.99 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.543 ' N ' ' O ' ' A' ' 24' ' ' VAL . 26.5 t-20 76.98 12.55 2.26 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 122.033 -0.417 . . . . 0.0 110.143 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 16.5 mtp-105 -98.3 -178.12 3.93 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 121.03 -1.044 . . . . 0.0 109.856 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.521 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 20.3 m-20 -135.97 116.68 13.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 32' ' ' THR . 29.6 t -115.93 158.04 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-O 121.626 0.727 . . . . 0.0 109.772 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.453 ' N ' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -132.72 131.05 40.81 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.912 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.43 HD22 ' O ' ' A' ' 32' ' ' THR . 2.7 mm? -115.45 118.11 32.26 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.675 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -60.41 139.59 57.61 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 178.459 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.599 ' HB ' HG11 ' A' ' 39' ' ' VAL . 5.5 m -160.26 -175.16 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.443 0 CA-C-O 121.882 0.849 . . . . 0.0 109.741 -177.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.519 ' O ' HG12 ' A' ' 39' ' ' VAL . 15.1 p -140.49 173.05 11.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.97 49.74 4.02 Favored Glycine 0 C--N 1.29 -2.009 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -153.5 1.69 0.26 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.76 -0.847 . . . . 0.0 109.356 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.599 HG11 ' HB ' ' A' ' 35' ' ' VAL . 0.2 OUTLIER -85.8 151.41 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.717 -1.239 . . . . 0.0 108.303 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.489 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.1 OUTLIER -87.67 142.75 27.59 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 121.235 -0.916 . . . . 0.0 109.17 179.798 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.65 HD13 ' HB3' ' A' ' 72' ' ' LEU . 38.6 mt -47.16 -57.81 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-O 122.179 0.99 . . . . 0.0 109.222 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.413 ' H ' HG23 ' A' ' 75' ' ' THR . . . -53.69 -14.36 3.71 Favored Glycine 0 C--N 1.295 -1.733 0 N-CA-C 108.512 -1.835 . . . . 0.0 108.512 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.79 -25.48 62.48 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -79.58 -55.09 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.413 -1.051 . . . . 0.0 109.757 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -21.95 4.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.449 -1.407 . . . . 0.0 108.585 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.504 ' C ' HD23 ' A' ' 46' ' ' LEU . 3.2 tt -71.69 -58.32 3.59 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -61.76 -51.87 66.56 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.306 -0.871 . . . . 0.0 110.625 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.432 HD21 ' CD1' ' A' ' 92' ' ' PHE . 57.3 tp -44.82 -54.24 6.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.089 -1.007 . . . . 0.0 110.604 -178.122 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.88 -44.06 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 120.722 -1.236 . . . . 0.0 110.098 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -45.01 -38.45 4.81 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.125 -0.985 . . . . 0.0 109.986 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.532 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.3 mtmp? -67.91 -48.5 65.81 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.381 -0.824 . . . . 0.0 110.421 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.8 OUTLIER -65.0 -68.11 0.39 Allowed 'General case' 0 C--N 1.307 -1.262 0 O-C-N 120.877 -1.139 . . . . 0.0 108.33 179.956 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 10.2 t0 80.36 88.23 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.119 0.962 . . . . 0.0 110.377 178.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.488 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -169.78 140.12 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.285 -2.223 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.276 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -67.32 35.54 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.639 -0.663 . . . . 0.0 110.567 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.488 ' H ' ' C ' ' A' ' 54' ' ' VAL . 13.6 ttmm -78.81 144.9 34.64 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 118.385 -1.326 . . . . 0.0 108.85 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.526 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 4.4 m-20 -54.73 96.11 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.628 -0.67 . . . . 0.0 110.073 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.47 ' O ' ' N ' ' A' ' 61' ' ' HIS . 47.6 m95 -107.21 -29.64 9.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.329 -0.857 . . . . 0.0 109.612 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 p -44.33 -42.89 7.11 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.617 -0.677 . . . . 0.0 110.149 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 15.7 t0 -75.1 -15.87 60.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.385 -0.822 . . . . 0.0 109.621 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.526 ' CE1' ' O ' ' A' ' 57' ' ' ASP . 2.4 m80 -85.18 128.36 34.64 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.209 -0.932 . . . . 0.0 110.789 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -139.3 176.82 8.38 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.775 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.7 mm? -94.75 145.12 25.09 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.818 -1.176 . . . . 0.0 110.304 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.516 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.21 151.53 49.15 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.539 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.84 94.7 5.08 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.078 -1.014 . . . . 0.0 108.97 -179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.415 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 10.4 pt-20 -56.04 -23.69 34.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.23 -0.919 . . . . 0.0 110.762 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.523 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.9 mmtp -68.39 -9.57 49.21 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 178.673 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.27 -12.14 2.8 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.983 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.539 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.65 46.65 26.32 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.8 t -115.06 -170.73 1.81 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.313 0.578 . . . . 0.0 109.774 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.532 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.55 97.42 4.54 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.525 -1.657 . . . . 0.0 106.525 177.212 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 41' ' ' ILE . 11.1 mt -60.85 85.32 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.901 -1.124 . . . . 0.0 110.05 -176.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -119.97 10.27 11.46 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.461 ' HD3' HD12 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -91.54 68.52 5.7 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.427 -0.796 . . . . 0.0 109.398 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.417 ' O ' ' O ' ' B' ' 605' ' ' CYS . 3.7 m -60.24 -5.51 1.13 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.995 -1.065 . . . . 0.0 108.968 179.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.44 ' H ' ' C ' ' A' ' 74' ' ' LYS . 40.1 m80 -59.27 -61.75 2.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.836 . . . . 0.0 112.099 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.461 ' CH2' HD11 ' A' ' 41' ' ' ILE . 11.7 p-90 -88.07 -159.01 0.5 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.689 -1.257 . . . . 0.0 110.852 -178.011 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.664 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -139.23 165.27 27.62 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.92 -1.113 . . . . 0.0 110.24 -178.208 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.471 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 11.1 mp -38.95 -65.4 0.37 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.076 0.941 . . . . 0.0 109.721 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -44.49 -52.29 8.04 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.852 0.834 . . . . 0.0 110.259 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.664 ' CG ' ' H ' ' A' ' 78' ' ' THR . 40.9 mmtt -45.25 -54.65 6.76 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.46 0.648 . . . . 0.0 109.722 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.86 -43.85 57.34 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.098 -1.041 . . . . 0.0 108.908 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 119.13 11.64 7.4 Favored Glycine 0 N--CA 1.5 2.913 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.498 HG22 ' N ' ' A' ' 85' ' ' GLN . 33.7 mt -61.21 161.19 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.574 -0.957 . . . . 0.0 108.866 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.498 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.3 tp60 -161.99 -169.15 2.11 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.297 -0.877 . . . . 0.0 109.239 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.537 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -69.91 -19.97 63.38 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.614 -0.679 . . . . 0.0 109.562 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.3 p30 -80.47 -8.26 59.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.289 -0.882 . . . . 0.0 109.184 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.524 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -93.07 113.35 25.59 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -93.28 115.88 28.46 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.767 -1.208 . . . . 0.0 109.551 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.406 ' HG ' HD12 ' A' ' 20' ' ' LEU . 9.9 mt -97.55 176.99 5.65 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.698 0.761 . . . . 0.0 109.507 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.516 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -132.81 168.59 18.11 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.194 -1.409 . . . . 0.0 107.194 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.432 ' CD1' HD21 ' A' ' 48' ' ' LEU . 20.2 t80 -133.31 99.35 4.5 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.23 0 C-N-CA 120.214 -0.595 . . . . 0.0 111.642 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m . . . . . 0 N--CA 1.488 1.447 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -59.03 135.04 57.5 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.783 -1.198 . . . . 0.0 110.211 -178.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.52 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.62 103.73 13.17 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.6 t -48.82 125.1 9.6 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-O 122.035 0.921 . . . . 0.0 109.639 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.5 -34.62 5.38 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 106.479 -2.648 . . . . 0.0 106.479 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.3 m -105.31 -35.26 7.6 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 54.55 56.42 6.84 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.824 1.297 . . . . 0.0 109.881 -178.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -140.71 123.62 9.92 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -44.24 134.09 8.94 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 CA-C-N 120.574 1.241 . . . . 0.0 114.433 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.3 mt -91.74 98.31 8.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 557' ' ' THR . . . . . 0.429 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.5 p -99.46 91.01 4.72 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.286 -0.884 . . . . 0.0 111.159 -177.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.74 -96.2 0.15 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.462 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.6 mmt-85 -113.88 150.58 33.44 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 177.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 26.5 p -144.46 126.66 15.67 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.951 -1.093 . . . . 0.0 111.76 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 40.9 mt -91.32 146.68 5.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.438 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 12.2 m -120.72 146.53 46.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 121.81 0.814 . . . . 0.0 108.897 179.486 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.724 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.7 -129.02 0.26 Allowed 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.5 mtp -65.79 25.89 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.559 -0.713 . . . . 0.0 109.147 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.724 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.11 -8.51 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 -178.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.25 148.7 28.24 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -95.94 174.65 6.83 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.49 137.57 8.04 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.142 -1.423 . . . . 0.0 110.121 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.612 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.0 m80 -57.9 117.05 16.65 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.436 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 50.4 Cg_exo -44.11 -8.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.302 0 CA-C-N 120.114 1.076 . . . . 0.0 112.758 -178.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.717 ' O ' HG13 ' B' ' 574' ' ' VAL . 8.2 mt-10 -106.41 -53.16 2.67 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 122.149 0.976 . . . . 0.0 109.623 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.47 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 15.4 m170 -55.5 -5.0 0.11 Allowed 'General case' 0 C--N 1.292 -1.927 0 O-C-N 120.312 -1.493 . . . . 0.0 109.495 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.492 ' H ' ' C ' ' B' ' 571' ' ' GLU . 39.8 t80 -125.44 52.96 1.58 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.717 HG13 ' O ' ' B' ' 571' ' ' GLU . 11.6 m -92.93 177.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.639 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -80.39 141.85 34.95 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.53 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.4 75.6 3.89 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 116.842 -1.943 . . . . 0.0 109.915 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 577' ' ' PHE . . . . . 0.407 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 69.1 t80 -153.33 -54.12 0.11 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 102.459 -3.163 . . . . 0.0 102.459 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.521 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.7 p -126.75 77.75 1.74 Allowed 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 111.68 -2.509 . . . . 0.0 104.396 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 0.703 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.3 mp -53.04 16.85 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.521 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.1 -37.71 21.67 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 119.545 -1.972 . . . . 0.0 112.233 -178.718 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.488 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.6 tp-100 -161.54 143.89 11.92 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 119.54 -1.975 . . . . 0.0 113.843 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.639 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.5 tp -136.62 170.59 15.82 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' B' ' 587' ' ' PHE . 70.3 m-20 -149.61 131.79 15.44 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.182 -0.949 . . . . 0.0 109.455 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.438 ' HE3' ' H ' ' B' ' 562' ' ' THR . 14.7 ptpt -51.11 -19.16 1.03 Allowed 'General case' 0 C--N 1.302 -1.494 0 CA-C-O 121.564 0.697 . . . . 0.0 109.813 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.0 -20.54 55.28 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -134.34 26.62 3.8 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.52 107.73 19.35 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 122.657 1.218 . . . . 0.0 110.389 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.97 166.25 10.56 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.428 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.1 tt0 -153.01 157.28 40.3 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.815 -1.178 . . . . 0.0 110.653 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.428 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 1.6 tp-100 -156.22 146.13 21.2 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.477 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 46.41 23.65 0.24 Allowed 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.041 -1.037 . . . . 0.0 109.643 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 81.55 -5.74 1.55 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.782 -0.574 . . . . 0.0 110.8 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -88.34 116.25 65.67 Favored Pre-proline 0 C--N 1.294 -1.806 0 O-C-N 121.206 -0.934 . . . . 0.0 109.54 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.515 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 42.6 Cg_exo -49.51 164.2 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 CA-C-N 119.908 1.003 . . . . 0.0 112.141 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.515 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.77 140.03 1.6 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.179 -0.951 . . . . 0.0 110.163 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 596' ' ' CYS . . . . . 0.4 ' HG ' ' CB ' ' B' ' 575' ' ' CYS . 11.0 m -73.51 152.88 40.53 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 174.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -55.69 -57.46 11.9 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -45.35 -29.44 1.05 Allowed 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.58 -0.7 . . . . 0.0 109.316 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 76.2 m -84.62 -66.17 0.92 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.611 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -43.86 -56.5 3.84 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.656 0.741 . . . . 0.0 109.577 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.643 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.73 -43.31 62.83 Favored 'General case' 0 C--N 1.293 -1.854 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -178.802 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -64.69 -20.48 66.34 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.705 -1.247 . . . . 0.0 110.807 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -90.17 -56.46 3.21 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.3 -1.5 . . . . 0.0 112.067 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.29 30.73 4.37 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.223 -0.923 . . . . 0.0 112.381 -176.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.417 ' O ' ' O ' ' A' ' 75' ' ' THR . 2.4 t . . . . . 0 N--CA 1.5 2.058 0 O-C-N 120.604 -1.31 . . . . 0.0 108.805 178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.531 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.494 2.529 0 N-CA-C 108.443 -1.863 . . . . 0.0 108.443 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.92 122.4 23.37 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.568 -0.96 . . . . 0.0 109.532 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.531 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -133.01 124.55 27.9 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.616 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.12 128.71 34.21 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.819 -1.176 . . . . 0.0 109.134 -179.798 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.516 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.01 133.35 34.68 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.573 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.55 145.5 34.8 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.396 -0.815 . . . . 0.0 110.019 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.8 t -135.2 100.42 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.762 0.792 . . . . 0.0 109.066 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.534 ' CE1' ' OD1' ' A' ' 30' ' ' ASP . 7.7 m-70 -77.94 104.06 8.26 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.549 HG13 ' CD1' ' A' ' 92' ' ' PHE . 4.8 t -74.75 117.88 19.62 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.128 -1.429 . . . . 0.0 108.965 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.423 ' H ' HG23 ' A' ' 25' ' ' THR . 0.6 OUTLIER -85.27 -23.6 28.11 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.371 -0.831 . . . . 0.0 109.72 -179.333 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.481 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -79.92 -8.86 59.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.0 108.373 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.404 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.0 mt -129.0 -23.62 3.02 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.523 ' N ' ' O ' ' A' ' 24' ' ' VAL . 29.2 t-20 76.22 12.11 2.78 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -94.92 -177.96 4.34 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.197 -0.939 . . . . 0.0 109.445 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.534 ' OD1' ' CE1' ' A' ' 23' ' ' HIS . 2.1 m-20 -136.7 113.19 10.06 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.401 HG12 ' N ' ' A' ' 32' ' ' THR . 21.4 t -107.76 157.48 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.494 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.2 139.79 47.19 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 2.3 mm? -120.16 112.55 19.23 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.663 -0.648 . . . . 0.0 109.56 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -61.47 107.01 0.72 Allowed 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -135.33 -168.94 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 CA-C-O 121.842 0.83 . . . . 0.0 110.339 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.6 p -141.84 173.35 11.59 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.17 44.52 2.65 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.431 ' C ' HG21 ' A' ' 78' ' ' THR . 0.2 OUTLIER -144.67 2.95 1.09 Allowed 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.615 -0.932 . . . . 0.0 108.843 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.575 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -89.08 135.21 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 O-C-N 121.146 -0.971 . . . . 0.0 110.259 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.488 ' O ' ' N ' ' A' ' 43' ' ' GLY . 9.4 m-70 -78.4 148.2 33.75 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.921 -1.112 . . . . 0.0 108.866 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.529 HD12 ' O ' ' A' ' 74' ' ' LYS . 38.7 mt -47.36 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.131 -0.981 . . . . 0.0 109.251 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.56 -13.36 2.87 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 108.625 -1.79 . . . . 0.0 108.625 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -82.23 -26.94 46.28 Favored Glycine 0 N--CA 1.483 1.833 0 N-CA-C 109.261 -1.536 . . . . 0.0 109.261 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.7 t -80.79 -55.26 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -1.105 . . . . 0.0 109.543 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.463 ' SD ' HD22 ' B' ' 603' ' ' LEU . 0.0 OUTLIER -49.56 -40.58 38.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.766 -1.209 . . . . 0.0 108.996 179.771 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.8 tt -54.47 -58.88 5.73 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.079 -1.013 . . . . 0.0 109.35 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -59.39 -57.84 11.22 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.246 -0.909 . . . . 0.0 110.919 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.5 tp -44.81 -41.73 7.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.366 -0.834 . . . . 0.0 110.182 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.634 HG22 ' CD2' ' A' ' 58' ' ' TRP . 93.2 t -74.67 -43.49 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.821 -1.174 . . . . 0.0 109.52 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -45.79 -38.87 7.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.257 -0.902 . . . . 0.0 108.933 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.533 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 54.5 mttp -67.44 -57.38 6.66 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.479 -0.763 . . . . 0.0 109.294 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.536 ' C ' ' H ' ' A' ' 54' ' ' VAL . 3.8 mm? -67.78 -66.22 0.59 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.523 ' N ' ' O ' ' A' ' 49' ' ' VAL . 2.8 t70 78.0 -34.02 0.18 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.875 0.845 . . . . 0.0 109.627 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.536 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.4 p -20.15 134.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.169 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.481 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.453 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.3 tttt -69.9 36.42 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.133 -0.98 . . . . 0.0 110.457 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.494 ' NZ ' ' CB ' ' A' ' 56' ' ' LYS . 3.2 ttpm? -83.97 169.21 15.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.919 . . . . 0.0 108.531 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.535 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -79.71 123.54 27.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.021 -1.049 . . . . 0.0 109.545 -179.828 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.651 ' CZ3' ' CZ ' ' A' ' 92' ' ' PHE . 93.3 m95 -119.09 -48.54 2.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.453 -0.779 . . . . 0.0 109.934 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 p -45.51 -55.97 5.61 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.15 -0.968 . . . . 0.0 109.913 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -55.17 -32.17 61.95 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.535 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 8.8 m-70 -83.55 168.74 16.13 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.981 0.896 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.58 178.57 4.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.817 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -94.24 148.59 22.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.87 -1.144 . . . . 0.0 108.863 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.514 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.35 151.32 48.92 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.799 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.54 94.01 4.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.626 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.41 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 17.9 pt-20 -55.12 -24.2 24.86 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.316 -0.865 . . . . 0.0 111.028 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.534 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.4 mmtp -68.43 -8.81 43.99 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -133.76 -12.89 2.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.783 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 52.68 45.83 27.89 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -178.201 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -111.86 -173.61 2.28 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.311 0.577 . . . . 0.0 109.732 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.51 5.66 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 177.551 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 35.2 mt -59.81 82.6 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.047 0 O-C-N 120.661 -1.274 . . . . 0.0 110.745 -176.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.553 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -115.38 4.62 14.4 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.539 ' NZ ' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -80.59 72.08 7.49 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' HIS . 46.5 m -44.74 -53.09 7.72 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.204 -0.935 . . . . 0.0 109.742 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.518 ' CE1' ' HG ' ' B' ' 605' ' ' CYS . 45.5 m-70 -51.9 -179.31 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.362 -0.836 . . . . 0.0 109.134 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 23.3 m0 55.92 173.65 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.741 0.781 . . . . 0.0 109.124 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.692 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -131.2 -164.6 1.46 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.681 0.753 . . . . 0.0 109.24 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.563 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.1 mp -70.68 -58.4 3.69 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -43.77 -52.4 6.64 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.67 0.748 . . . . 0.0 109.702 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.692 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.0 mmtt -46.11 -54.43 8.59 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.628 0.727 . . . . 0.0 109.558 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.539 ' OH ' ' NZ ' ' A' ' 74' ' ' LYS . 2.2 m-85 -72.59 -42.05 64.98 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.143 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.19 6.1 14.07 Favored Glycine 0 N--CA 1.5 2.966 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.515 HG22 ' N ' ' A' ' 85' ' ' GLN . 52.0 mt -61.63 161.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.765 -0.844 . . . . 0.0 109.784 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.515 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.7 tp60 -172.05 -162.91 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.19 70.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.368 -0.832 . . . . 0.0 109.956 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.416 ' OD2' ' O ' ' A' ' 87' ' ' ASP . 1.0 OUTLIER -68.42 -13.19 62.12 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -96.81 112.56 24.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -96.23 116.21 28.64 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.928 -1.107 . . . . 0.0 109.594 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.516 ' HG ' HD12 ' A' ' 20' ' ' LEU . 6.8 mt -91.99 175.73 6.76 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.514 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.7 mt-30 -134.68 160.34 38.44 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.651 ' CZ ' ' CZ3' ' A' ' 58' ' ' TRP . 0.1 OUTLIER -119.16 96.45 5.23 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.998 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.503 2.197 0 O-C-N 121.858 -0.526 . . . . 0.0 110.266 -177.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.524 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.7 m . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.6 mp -58.45 133.81 56.1 Favored 'General case' 0 C--N 1.293 -1.85 0 O-C-N 120.696 -1.253 . . . . 0.0 110.74 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.499 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.61 104.08 13.44 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.1 t -50.84 126.66 16.51 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 122.23 1.014 . . . . 0.0 109.728 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.37 5.5 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 106.216 -2.753 . . . . 0.0 106.216 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.7 m -105.72 -36.15 7.15 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.65 56.2 6.42 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 122.719 1.247 . . . . 0.0 110.015 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -140.63 123.92 10.15 Favored Pre-proline 0 N--CA 1.497 1.88 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -44.07 133.94 8.52 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 CA-C-N 120.536 1.227 . . . . 0.0 114.488 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.524 ' N ' ' O ' ' B' ' 547' ' ' SER . 36.9 mt -91.85 98.53 8.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.77 92.13 5.17 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.203 -0.936 . . . . 0.0 111.338 -178.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.27 -95.24 0.15 Allowed Glycine 0 N--CA 1.488 2.118 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 10.0 mmt180 -114.2 151.13 33.23 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.1 p -144.45 126.25 15.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.944 -1.097 . . . . 0.0 111.676 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 41.0 mt -91.43 146.77 5.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.679 ' H ' ' HZ2' ' B' ' 584' ' ' LYS . 8.6 m -117.61 146.6 43.53 Favored 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.709 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.2 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.61 0.719 . . . . 0.0 109.389 -178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.549 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.9 mtp -65.96 26.44 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.709 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.12 -8.96 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 -178.005 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -82.14 161.92 22.65 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -103.77 174.66 5.77 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -161.09 135.07 6.89 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 118.03 -1.468 . . . . 0.0 110.089 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.586 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.8 m80 -55.53 116.0 10.79 Favored Pre-proline 0 C--N 1.301 -1.533 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.435 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 41.8 Cg_exo -46.46 -9.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.384 0 CA-C-N 120.27 1.132 . . . . 0.0 111.642 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.677 ' O ' HG13 ' B' ' 574' ' ' VAL . 10.4 mt-10 -99.75 -52.41 3.46 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.418 1.104 . . . . 0.0 109.738 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.47 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.6 m170 -59.06 -3.2 0.33 Allowed 'General case' 0 C--N 1.289 -2.028 0 O-C-N 120.41 -1.432 . . . . 0.0 109.618 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.48 ' H ' ' C ' ' B' ' 571' ' ' GLU . 23.2 t80 -132.38 58.86 1.74 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.677 HG13 ' O ' ' B' ' 571' ' ' GLU . 7.7 m -93.91 177.98 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.659 0.742 . . . . 0.0 110.777 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.617 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -75.52 145.64 41.17 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.95 75.7 3.11 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 116.661 -2.015 . . . . 0.0 109.935 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 577' ' ' PHE . . . . . 0.429 ' HE2' HG21 ' A' ' 49' ' ' VAL . 0.9 OUTLIER -153.1 -61.61 0.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 102.264 -3.236 . . . . 0.0 102.264 173.05 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.542 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.3 p -118.41 82.78 1.9 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 111.881 -2.418 . . . . 0.0 105.069 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mp -52.66 16.36 0.0 OUTLIER 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.75 -36.82 21.5 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 119.573 -1.954 . . . . 0.0 112.78 -178.153 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.499 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.6 tp-100 -161.9 142.13 10.33 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 119.262 -2.149 . . . . 0.0 114.941 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.617 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.5 tp -140.38 167.63 21.7 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.44 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.526 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.7 m-20 -150.8 134.78 16.73 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.236 -0.915 . . . . 0.0 109.235 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.679 ' HZ2' ' H ' ' B' ' 562' ' ' THR . 1.8 ptpp? -52.58 -18.65 1.84 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.229 -0.919 . . . . 0.0 109.292 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.46 -18.19 57.43 Favored Glycine 0 N--CA 1.485 1.938 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.68 25.17 3.4 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.906 -0.761 . . . . 0.0 108.989 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.554 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -91.08 109.08 20.32 Favored 'General case' 0 N--CA 1.501 2.078 0 CA-C-O 122.564 1.173 . . . . 0.0 110.029 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -105.7 169.91 8.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 107.516 -1.291 . . . . 0.0 107.516 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.425 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.2 tt0 -152.62 157.19 40.63 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.737 -1.227 . . . . 0.0 110.616 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.425 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 1.8 tp60 -157.1 146.52 20.35 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.473 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.0 OUTLIER 47.89 22.93 0.41 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.923 -1.11 . . . . 0.0 109.59 -179.323 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.473 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 81.81 -7.03 1.43 Allowed 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.789 -0.57 . . . . 0.0 111.234 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 593' ' ' LYS . . . . . 0.402 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 38.3 mttm -89.59 121.07 69.5 Favored Pre-proline 0 C--N 1.297 -1.711 0 O-C-N 121.033 -1.042 . . . . 0.0 109.711 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.537 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.5 Cg_exo -49.61 164.18 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.235 0 CA-C-N 120.174 1.098 . . . . 0.0 111.656 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.537 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.6 m-85 -170.28 139.95 1.81 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.242 -0.911 . . . . 0.0 109.873 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 3.8 m -69.69 154.08 42.49 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 175.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -59.09 -57.59 12.39 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 178.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.8 -29.68 1.41 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 4.6 m -82.43 -67.55 0.78 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.639 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.32 -59.16 3.1 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.523 0.678 . . . . 0.0 110.224 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.65 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -50.44 -42.7 54.53 Favored 'General case' 0 C--N 1.293 -1.851 0 O-C-N 121.539 -0.725 . . . . 0.0 109.429 -178.567 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 8.7 tptp -62.78 -22.84 66.89 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.089 -1.007 . . . . 0.0 111.199 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.468 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -92.92 -44.69 8.32 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.325 -1.484 . . . . 0.0 110.26 -179.07 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.447 ' O ' ' C ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -120.06 32.85 5.85 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.528 -0.733 . . . . 0.0 109.831 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.518 ' HG ' ' CE1' ' A' ' 76' ' ' HIS . 0.8 OUTLIER . . . . . 0 N--CA 1.503 2.2 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.502 0 N-CA-C 108.542 -1.823 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.5 p -93.92 122.07 36.04 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.551 -0.97 . . . . 0.0 109.475 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.441 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -125.78 123.51 38.94 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.617 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.23 129.99 34.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 108.807 -179.806 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.446 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.34 131.46 35.06 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.66 34.68 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.287 -0.883 . . . . 0.0 110.098 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 33.1 t -136.39 106.96 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 CA-C-O 121.67 0.747 . . . . 0.0 109.21 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.502 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 5.9 m170 -77.81 103.43 7.75 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 178.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.564 HG13 ' CD1' ' A' ' 92' ' ' PHE . 2.1 t -69.35 107.38 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.621 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' LEU . 11.5 p -74.27 -65.31 0.86 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.542 -0.724 . . . . 0.0 111.122 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' OG1' ' A' ' 25' ' ' THR . 19.3 t0 -46.9 -13.15 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.088 -1.007 . . . . 0.0 110.027 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.549 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.5 mm? -112.12 -48.03 3.07 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.424 -0.797 . . . . 0.0 109.062 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 36.4 t-20 98.02 13.06 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.426 HH21 ' HB2' ' A' ' 29' ' ' ARG . 5.1 mtp-105 -94.77 -176.85 4.0 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.125 0.965 . . . . 0.0 109.702 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.502 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 2.4 m-20 -138.34 116.02 11.41 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.438 HG12 ' N ' ' A' ' 32' ' ' THR . 42.6 t -113.15 155.96 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-O 121.532 0.682 . . . . 0.0 109.341 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -134.56 133.92 40.79 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.551 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.424 HD22 ' O ' ' A' ' 32' ' ' THR . 2.7 mm? -113.85 113.16 24.51 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -60.26 107.58 0.67 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.4 m -134.5 -169.77 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.822 0.82 . . . . 0.0 110.114 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.9 p -142.61 173.25 11.7 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.441 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -78.89 46.61 2.95 Favored Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.433 ' C ' HG21 ' A' ' 78' ' ' THR . 6.4 pt-20 -148.57 4.89 0.69 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.675 -0.897 . . . . 0.0 108.982 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.615 ' O ' HG22 ' A' ' 78' ' ' THR . 2.3 m -90.49 144.31 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.01 -1.057 . . . . 0.0 110.174 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.492 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 p-80 -84.47 146.45 27.6 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.924 -1.11 . . . . 0.0 108.797 178.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 68.3 mt -48.93 -53.68 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 120.937 -1.102 . . . . 0.0 108.683 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.72 -15.32 4.49 Favored Glycine 0 N--CA 1.485 1.945 0 N-CA-C 108.148 -1.981 . . . . 0.0 108.148 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -76.85 -30.62 55.67 Favored Glycine 0 N--CA 1.483 1.777 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -83.71 -43.47 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.61 -0.935 . . . . 0.0 108.62 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.58 -37.67 12.87 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.112 -0.992 . . . . 0.0 108.389 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -70.21 -61.06 1.92 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.657 -0.652 . . . . 0.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -53.89 -59.22 4.91 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.178 -0.952 . . . . 0.0 111.663 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.18 -44.3 10.76 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.072 -1.017 . . . . 0.0 110.088 -177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 52' ' ' LEU . 24.6 t -70.89 -46.76 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.138 -0.976 . . . . 0.0 109.418 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -44.7 -37.75 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.31 -0.869 . . . . 0.0 109.646 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.487 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 7.8 mtmp? -71.46 -33.8 69.65 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.446 -0.784 . . . . 0.0 109.585 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.1 tp -64.01 -67.9 0.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 t70 67.03 78.76 0.24 Allowed 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.807 0.813 . . . . 0.0 110.572 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.569 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -171.9 149.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.623 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.46 33.97 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.264 -0.897 . . . . 0.0 109.028 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.569 ' H ' ' C ' ' A' ' 54' ' ' VAL . 43.3 tttp -78.07 164.55 24.93 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.313 -0.867 . . . . 0.0 109.146 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.14 91.57 4.34 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.358 -0.838 . . . . 0.0 109.154 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -72.35 -52.05 17.87 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.566 ' C ' ' H ' ' A' ' 61' ' ' HIS . 76.1 p -47.82 -41.84 24.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.62 -0.675 . . . . 0.0 110.008 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -53.99 -4.83 0.06 Allowed 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.25 -0.907 . . . . 0.0 109.091 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.596 ' CG ' ' CE2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -119.12 161.62 20.0 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-O 122.008 0.909 . . . . 0.0 110.129 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . . . -169.99 165.56 9.45 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.76 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -93.35 132.88 37.16 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.603 -1.311 . . . . 0.0 109.637 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -119.73 147.85 44.1 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.618 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -108.29 93.0 4.29 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.112 -0.992 . . . . 0.0 108.551 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -54.95 -24.12 22.35 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.243 -0.911 . . . . 0.0 110.895 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.538 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 26.0 mmtt -68.58 -8.28 40.31 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -133.86 -12.75 2.56 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.553 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.9 OUTLIER 52.86 45.77 28.1 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -178.236 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -113.02 -173.2 2.2 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.423 0.63 . . . . 0.0 109.914 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.71 98.61 5.05 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 177.082 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.417 ' HB3' HD13 ' A' ' 41' ' ' ILE . 21.6 mt -60.67 82.98 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 O-C-N 120.86 -1.15 . . . . 0.0 110.449 -176.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -117.79 6.84 12.35 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.424 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -84.11 68.78 10.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.759 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.414 ' C ' ' O ' ' A' ' 74' ' ' LYS . 28.4 m -40.84 -38.5 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.542 -0.724 . . . . 0.0 110.073 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 15.4 m80 -58.72 171.45 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.266 -0.896 . . . . 0.0 108.964 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 16.7 m0 56.51 168.17 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.61 0.719 . . . . 0.0 109.737 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.665 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -121.7 -164.48 1.15 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.693 0.758 . . . . 0.0 109.477 -178.823 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 79' ' ' LEU . 4.8 mp -70.41 -59.44 2.86 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -42.82 -51.91 5.25 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.833 0.825 . . . . 0.0 109.755 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.665 ' CG ' ' H ' ' A' ' 78' ' ' THR . 23.0 mmtp -47.16 -54.68 10.05 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.742 0.782 . . . . 0.0 109.362 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.21 -43.37 74.26 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.345 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.77 4.23 17.24 Favored Glycine 0 N--CA 1.499 2.843 0 N-CA-C 108.176 -1.97 . . . . 0.0 108.176 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.499 HG22 ' N ' ' A' ' 85' ' ' GLN . 45.4 mt -61.55 161.21 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.772 -0.84 . . . . 0.0 109.331 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.499 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.6 tp60 -173.15 -166.29 0.34 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.463 -0.773 . . . . 0.0 109.134 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.38 -22.83 64.63 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.409 -0.807 . . . . 0.0 109.968 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -77.41 -11.37 59.83 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.03 113.03 25.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -97.08 118.09 32.72 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.095 -1.003 . . . . 0.0 109.541 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.9 mt -94.63 177.13 6.02 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 4.8 mt-30 -132.89 158.61 42.12 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.329 -1.359 . . . . 0.0 107.329 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.596 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -101.33 109.35 21.18 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.294 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 62' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.806 0 O-C-N 120.555 -1.34 . . . . 0.0 109.459 -177.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.534 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -59.96 135.57 57.75 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 120.938 -1.102 . . . . 0.0 110.431 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.485 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.58 103.93 13.3 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 178.196 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.3 t -51.28 127.08 18.58 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.245 1.021 . . . . 0.0 109.727 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.6 -34.79 5.27 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 106.206 -2.758 . . . . 0.0 106.206 -177.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.5 m -105.4 -35.93 7.34 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.92 56.49 5.96 Favored 'General case' 0 C--N 1.3 -1.557 0 CA-C-O 122.694 1.235 . . . . 0.0 110.079 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp -140.47 123.6 10.14 Favored Pre-proline 0 N--CA 1.496 1.84 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -44.2 134.99 8.66 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.519 1.221 . . . . 0.0 114.743 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.1 mt -94.22 98.29 7.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.6 p -99.85 91.17 4.7 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.218 -0.926 . . . . 0.0 111.25 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.77 -95.9 0.15 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 107.584 -2.206 . . . . 0.0 107.584 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.474 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 11.5 mmt180 -112.48 151.31 30.08 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 22.3 p -144.77 126.29 15.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.957 -1.089 . . . . 0.0 111.438 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.97 146.65 5.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.886 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.4 m -118.28 146.78 44.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-O 121.853 0.835 . . . . 0.0 109.158 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.741 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.69 -129.11 0.26 Allowed 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 121.601 0.715 . . . . 0.0 109.441 -178.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 8.4 mtp -65.75 26.07 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.741 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.14 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.95 162.67 22.61 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -104.87 174.56 5.82 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.24 134.0 7.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.417 -1.427 . . . . 0.0 110.24 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.6 m80 -54.04 114.09 5.98 Favored Pre-proline 0 C--N 1.303 -1.443 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 176.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.434 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 37.0 Cg_exo -46.85 -11.45 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.381 1.172 . . . . 0.0 111.218 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.897 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.7 mt-10 -95.43 -51.79 4.42 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.046 0.927 . . . . 0.0 110.185 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.536 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.1 m170 -60.21 -3.56 0.64 Allowed 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.982 -1.074 . . . . 0.0 109.859 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.42 ' H ' ' C ' ' B' ' 571' ' ' GLU . 24.2 t80 -130.31 57.95 1.69 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.897 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.32 178.04 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-O 121.74 0.781 . . . . 0.0 111.167 -178.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.664 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.93 145.35 30.36 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.169 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -93.56 75.48 4.4 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.794 -1.962 . . . . 0.0 109.239 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -153.46 -64.74 0.15 Allowed 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 102.163 -3.273 . . . . 0.0 102.163 173.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.555 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -114.28 79.43 1.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 111.897 -2.411 . . . . 0.0 104.583 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 9.4 mt -52.86 16.0 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.84 -36.61 15.93 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 119.739 -1.851 . . . . 0.0 112.459 -178.904 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.427 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -158.83 140.1 13.13 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 119.562 -1.961 . . . . 0.0 114.822 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.664 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.1 tp -137.94 169.51 17.66 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.435 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.2 m-20 -148.0 130.79 16.06 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.285 -0.884 . . . . 0.0 109.041 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.886 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 0.6 OUTLIER -52.13 -17.2 0.99 Allowed 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.432 -0.793 . . . . 0.0 109.606 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.39 -20.6 51.54 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.24 27.59 4.13 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.85 108.78 19.91 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.589 1.185 . . . . 0.0 109.979 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.506 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.51 168.22 9.64 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.72 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.431 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.95 157.29 40.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.707 -1.246 . . . . 0.0 110.693 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.542 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 3.2 tp60 -155.25 145.96 22.28 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.476 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.2 OUTLIER 45.0 23.66 0.09 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.09 -1.006 . . . . 0.0 109.97 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 83.43 -6.48 1.17 Allowed 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.828 -0.545 . . . . 0.0 110.869 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -88.0 118.68 69.92 Favored Pre-proline 0 C--N 1.294 -1.816 0 O-C-N 121.279 -0.888 . . . . 0.0 109.559 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.513 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 37.0 Cg_exo -49.41 165.58 0.24 Allowed 'Trans proline' 0 N--CA 1.489 1.209 0 CA-C-N 120.089 1.067 . . . . 0.0 111.808 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.513 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.9 m-85 -170.82 137.66 1.29 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.133 -0.979 . . . . 0.0 110.473 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 28.5 m -70.36 155.63 40.41 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 104.247 -2.501 . . . . 0.0 104.247 174.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -59.11 -57.55 12.55 Favored 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 117.563 -1.655 . . . . 0.0 107.001 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -29.77 1.42 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 89.9 m -80.04 -65.62 0.98 Allowed 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.288 -0.882 . . . . 0.0 108.791 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.578 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.68 -55.86 17.02 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.751 -0.593 . . . . 0.0 110.048 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.692 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -47.06 -39.08 12.22 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.296 -0.877 . . . . 0.0 108.792 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt -67.91 -20.38 65.08 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.57 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 9.6 mt -90.66 -56.84 3.04 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.542 -1.349 . . . . 0.0 111.937 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.542 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 6.2 m-85 -91.61 -29.24 17.02 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.672 -1.268 . . . . 0.0 110.351 -178.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.422 ' O ' HD12 ' B' ' 601' ' ' LEU . 74.2 m . . . . . 0 N--CA 1.501 2.091 0 CA-C-O 118.062 -0.971 . . . . 0.0 109.448 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.493 2.473 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -85.46 122.83 30.16 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.435 -1.038 . . . . 0.0 109.274 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.417 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -131.79 123.15 27.02 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 179.258 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.14 129.82 35.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.982 . . . . 0.0 108.592 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.504 HD21 HG22 ' A' ' 84' ' ' ILE . 0.1 OUTLIER -83.31 131.57 35.07 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -77.85 145.63 36.17 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.444 -0.903 . . . . 0.0 109.296 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.1 t -138.93 113.53 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-O 121.868 0.842 . . . . 0.0 109.909 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.451 ' CG ' ' OD1' ' A' ' 30' ' ' ASP . 2.8 m80 -85.83 103.5 14.64 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.525 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -72.44 99.3 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 27' ' ' LEU . 59.2 p -73.67 -38.3 64.99 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.533 -0.729 . . . . 0.0 109.968 -178.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.41 18.16 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.061 -1.024 . . . . 0.0 108.627 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.9 mt -152.03 -30.53 0.16 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 24' ' ' VAL . 23.7 t-20 84.7 13.61 0.24 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 122.248 -0.282 . . . . 0.0 110.351 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -98.42 -178.2 3.94 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 120.954 -1.091 . . . . 0.0 109.952 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.451 ' OD1' ' CG ' ' A' ' 23' ' ' HIS . 32.1 m-20 -138.97 117.57 12.16 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.41 HG12 ' N ' ' A' ' 32' ' ' THR . 20.9 t -117.97 157.3 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-O 121.629 0.728 . . . . 0.0 110.096 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.443 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.79 135.33 43.79 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 179.686 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.538 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 2.4 mm? -116.51 112.29 21.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.566 -0.709 . . . . 0.0 109.336 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -60.66 103.92 0.3 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.414 ' HB ' HG11 ' A' ' 39' ' ' VAL . 22.1 m -136.28 -170.64 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.972 0.891 . . . . 0.0 110.338 -178.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.417 ' OG1' ' CG ' ' A' ' 38' ' ' GLU . 5.6 p -143.06 176.3 9.2 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.6 45.72 2.94 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.433 ' C ' HG21 ' A' ' 78' ' ' THR . 3.2 pt-20 -144.97 -0.13 0.92 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.295 -1.121 . . . . 0.0 108.605 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.455 ' O ' HG22 ' A' ' 78' ' ' THR . 1.7 m -87.89 134.11 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 121.006 -1.059 . . . . 0.0 109.81 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 m-70 -69.61 139.41 53.62 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 121.1 -1.0 . . . . 0.0 108.823 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.436 ' C ' ' N ' ' A' ' 43' ' ' GLY . 14.7 mt -47.31 -58.55 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.0 109.322 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.454 ' H ' HG22 ' A' ' 75' ' ' THR . . . -55.51 -13.19 5.38 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 108.219 -1.952 . . . . 0.0 108.219 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.84 -24.95 73.02 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 6.4 t -83.67 -38.5 14.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.482 ' O ' HG23 ' A' ' 49' ' ' VAL . 31.6 mtm -48.41 -37.39 16.88 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.426 ' CD1' HD13 ' B' ' 603' ' ' LEU . 2.1 tp -73.57 -61.27 1.89 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.738 -0.602 . . . . 0.0 110.788 -178.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -53.49 -61.27 2.41 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.214 -0.929 . . . . 0.0 110.889 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.6 tp -49.74 -35.06 20.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.277 -0.889 . . . . 0.0 109.416 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 45' ' ' MET . 9.2 t -73.02 -48.6 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.33 -0.856 . . . . 0.0 108.767 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -44.71 -37.44 3.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.536 -0.727 . . . . 0.0 109.559 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.538 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 55.5 mttp -71.16 -34.75 71.27 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.449 -0.782 . . . . 0.0 110.355 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.46 HD12 ' CG1' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.73 -63.24 1.33 Allowed 'General case' 0 C--N 1.306 -1.283 0 O-C-N 120.953 -1.092 . . . . 0.0 109.062 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 t70 69.54 78.3 0.21 Allowed 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.884 0.85 . . . . 0.0 109.895 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.553 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -171.51 147.42 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 C-N-CA 119.951 -0.699 . . . . 0.0 110.391 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -68.96 35.37 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.444 -0.785 . . . . 0.0 108.959 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.553 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.4 ttmm -78.34 154.64 30.65 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.12 -0.988 . . . . 0.0 108.817 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.22 97.75 0.75 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 108.767 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.541 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 45.7 m0 -80.45 -45.19 18.01 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.809 -0.557 . . . . 0.0 110.095 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.2 t -56.39 -56.61 19.03 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.995 -1.066 . . . . 0.0 110.399 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -49.83 -24.63 2.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.16 -0.963 . . . . 0.0 108.881 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.541 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -73.36 148.17 43.66 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.961 0.886 . . . . 0.0 109.731 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -160.68 152.6 19.94 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.826 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -94.79 143.06 26.76 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.141 -0.975 . . . . 0.0 109.716 -179.088 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.531 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.23 137.4 52.88 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.5 t90 -95.77 89.78 5.42 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.589 -0.694 . . . . 0.0 109.425 -179.279 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.477 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 14.4 pt-20 -53.98 -23.78 14.39 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.176 -0.952 . . . . 0.0 110.298 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.497 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.5 mmtp -63.91 -10.8 22.95 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.471 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -134.95 -12.3 2.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.212 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.6 44.95 29.07 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -110.03 -174.15 2.42 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.515 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.92 99.6 5.58 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 177.529 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.6 mt -59.88 83.75 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.053 0 CA-C-O 122.361 1.077 . . . . 0.0 110.662 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.5 6.69 10.07 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.133 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.444 ' CB ' ' NZ ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.73 74.04 5.27 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.21 -0.931 . . . . 0.0 109.542 -179.472 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.562 HG21 ' O ' ' B' ' 602' ' ' LYS . 11.8 p -75.93 -18.55 59.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.285 -0.884 . . . . 0.0 109.882 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -76.76 36.54 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.117 -0.989 . . . . 0.0 110.25 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -175.57 -143.81 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -152.96 149.53 28.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.851 -1.781 . . . . 0.0 109.506 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.681 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.3 pt? -40.2 -48.63 2.59 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.196 -0.94 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.423 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 18.0 t70 -47.23 -33.46 5.47 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.171 -0.956 . . . . 0.0 109.574 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.563 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.73 -31.08 70.77 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.563 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -79.02 -50.93 10.3 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 178.629 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.1 9.39 6.13 Favored Glycine 0 N--CA 1.509 3.562 0 N-CA-C 108.898 -1.681 . . . . 0.0 108.898 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.504 HG22 HD21 ' A' ' 20' ' ' LEU . 56.4 mt -60.63 161.35 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -164.47 -168.68 1.57 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.255 -0.903 . . . . 0.0 109.074 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.34 -23.04 65.58 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.284 -0.885 . . . . 0.0 110.157 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -2.24 56.99 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.196 -0.94 . . . . 0.0 108.908 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.481 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.37 113.03 25.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.527 -0.733 . . . . 0.0 109.641 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp -98.32 115.55 28.67 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.995 -1.066 . . . . 0.0 109.741 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.7 mt -95.38 176.11 6.32 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -133.58 156.63 47.48 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.538 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 2.2 t80 -115.21 126.4 54.51 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 O-C-N 120.992 -1.068 . . . . 0.0 110.274 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.536 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -58.15 135.67 57.1 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.893 -1.129 . . . . 0.0 110.375 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.53 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.01 104.12 13.82 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 178.467 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.52 125.4 11.24 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 122.077 0.941 . . . . 0.0 109.695 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -33.86 5.83 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 106.569 -2.612 . . . . 0.0 106.569 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.1 m -106.3 -35.52 7.13 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 54.97 56.65 6.38 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.793 1.283 . . . . 0.0 109.937 -178.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -140.66 123.77 10.04 Favored Pre-proline 0 C--N 1.295 -1.78 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -44.1 134.03 8.57 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 CA-C-N 120.461 1.2 . . . . 0.0 114.674 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.536 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.2 mt -92.65 98.37 8.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.9 p -99.71 91.16 4.73 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.301 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.1 -96.01 0.15 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.433 -2.267 . . . . 0.0 107.433 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -113.2 150.9 31.66 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.53 126.48 15.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.0 -1.062 . . . . 0.0 111.384 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.3 mt -90.57 146.21 6.47 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.3 m -121.21 146.4 46.84 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-O 121.982 0.896 . . . . 0.0 108.968 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.734 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -124.56 -127.9 0.25 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-O 122.092 0.949 . . . . 0.0 108.783 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 0.0 OUTLIER -65.51 28.1 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.734 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 103.43 -8.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 149.64 26.75 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -95.69 174.86 6.77 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -160.36 134.02 6.99 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 118.289 -1.365 . . . . 0.0 110.077 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.59 ' O ' ' N ' ' B' ' 571' ' ' GLU . 6.0 m80 -55.65 115.84 10.49 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 177.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.44 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 53.0 Cg_exo -45.32 -9.5 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.43 0 CA-C-N 120.298 1.142 . . . . 0.0 112.141 -178.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.931 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.3 mt-10 -102.03 -52.55 3.14 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 122.059 0.933 . . . . 0.0 109.978 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.515 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 16.7 m170 -56.88 -3.96 0.14 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.862 -1.149 . . . . 0.0 109.992 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.464 ' H ' ' C ' ' B' ' 571' ' ' GLU . 20.6 t80 -126.6 55.6 1.52 Allowed 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.931 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.1 m -94.25 177.68 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-O 121.711 0.767 . . . . 0.0 110.818 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.579 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.62 145.06 33.27 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.228 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.45 74.21 3.28 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 116.621 -2.031 . . . . 0.0 109.03 178.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.34 -47.45 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 102.87 -3.011 . . . . 0.0 102.87 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.572 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.6 p -132.95 81.28 1.93 Allowed 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.282 -2.236 . . . . 0.0 104.975 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 1.074 HD13 ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.67 15.5 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -176.459 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.09 -36.95 17.83 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 119.474 -2.016 . . . . 0.0 112.69 -178.302 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.402 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -160.36 140.1 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 119.416 -2.052 . . . . 0.0 114.969 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.579 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.6 tp -139.53 169.3 18.0 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.455 ' O ' ' N ' ' B' ' 587' ' ' PHE . 71.8 m-20 -145.62 130.55 18.23 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.159 -0.963 . . . . 0.0 108.864 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -52.44 -21.38 3.62 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.433 -0.792 . . . . 0.0 109.577 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.2 -16.35 60.94 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.6 p -134.66 26.27 3.7 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.906 -0.761 . . . . 0.0 108.971 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -88.64 109.69 20.32 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 122.443 1.116 . . . . 0.0 109.484 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.46 162.55 12.96 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.2 tt0 -153.83 156.89 38.48 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.558 1.17 . . . . 0.0 111.026 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.483 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 4.4 tt0 -156.46 141.52 17.25 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 105.985 -1.857 . . . . 0.0 105.985 178.141 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.55 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.95 25.81 3.32 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 120.846 -1.159 . . . . 0.0 109.288 178.925 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.8 m-20 79.85 -7.7 1.64 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.708 -0.62 . . . . 0.0 111.365 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 593' ' ' LYS . . . . . 0.458 ' O ' ' CE2' ' B' ' 595' ' ' TYR . 15.9 mttt -86.99 115.69 63.47 Favored Pre-proline 0 C--N 1.295 -1.791 0 O-C-N 121.153 -0.967 . . . . 0.0 110.282 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.597 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 32.7 Cg_exo -53.31 160.53 4.7 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 CA-C-N 119.969 1.025 . . . . 0.0 111.979 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.597 ' CD1' ' O ' ' B' ' 594' ' ' PRO . 51.8 m-85 -168.19 135.59 2.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.623 -0.673 . . . . 0.0 110.167 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.7 m -65.53 154.97 37.12 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 175.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -60.73 -57.35 13.06 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 178.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.09 -29.18 1.41 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 17.8 m -81.81 -61.18 1.99 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.537 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -56.59 -52.26 65.51 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.207 0.527 . . . . 0.0 110.133 -179.546 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.687 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -50.95 -43.33 60.26 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.055 -1.028 . . . . 0.0 109.072 -178.825 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.562 ' O ' HG21 ' A' ' 75' ' ' THR . 0.6 OUTLIER -55.59 -21.2 16.34 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.558 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.426 HD13 ' CD1' ' A' ' 46' ' ' LEU . 1.7 mt -94.24 -56.41 2.85 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.86 -1.15 . . . . 0.0 111.111 -178.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.487 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 23.9 m-85 -94.91 5.5 51.73 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.934 -1.104 . . . . 0.0 110.11 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.487 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 20.0 m . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.958 -1.089 . . . . 0.0 109.41 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.9 p -91.09 122.84 34.07 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.714 -0.874 . . . . 0.0 109.987 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -129.66 121.49 27.09 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.613 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.84 128.93 35.51 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.247 -0.908 . . . . 0.0 108.875 -179.664 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.546 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -83.67 132.3 34.89 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.411 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.56 145.71 34.67 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.726 -0.79 . . . . 0.0 110.22 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.9 t -135.4 103.97 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 CA-C-O 121.586 0.707 . . . . 0.0 109.49 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -78.05 104.48 8.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 178.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.547 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.4 t -69.83 108.77 2.21 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.003 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.8 p -77.42 162.86 26.89 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.4 t0 73.16 -43.74 0.57 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.49 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.4 mt -92.73 -36.67 12.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.248 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' VAL . 25.7 t-20 78.53 18.17 1.02 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.868 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -93.04 -178.94 4.95 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.834 -1.166 . . . . 0.0 109.436 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -137.93 113.87 9.9 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.2 t -110.58 152.37 12.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 CA-C-O 121.59 0.71 . . . . 0.0 109.45 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.448 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.82 130.52 38.05 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.448 HD22 ' C ' ' A' ' 32' ' ' THR . 2.9 mm? -114.22 112.98 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.687 -0.633 . . . . 0.0 109.39 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -59.79 105.63 0.4 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 m -135.37 -170.39 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 CA-C-O 121.812 0.815 . . . . 0.0 110.13 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 p -142.12 175.03 10.06 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.61 47.87 3.1 Favored Glycine 0 N--CA 1.483 1.799 0 N-CA-C 109.068 -1.613 . . . . 0.0 109.068 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.437 ' C ' HG21 ' A' ' 78' ' ' THR . 0.0 OUTLIER -147.38 -3.57 0.55 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.482 -1.01 . . . . 0.0 108.998 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 m -86.55 128.28 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.062 -1.024 . . . . 0.0 110.081 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 43' ' ' GLY . 5.6 m-70 -63.36 149.76 45.04 Favored 'General case' 0 C--N 1.29 -1.992 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.985 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.446 ' C ' ' N ' ' A' ' 43' ' ' GLY . 25.4 mt -49.64 -54.69 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.972 -1.08 . . . . 0.0 108.523 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.653 ' H ' HG23 ' A' ' 75' ' ' THR . . . -56.06 -12.2 5.34 Favored Glycine 0 C--N 1.299 -1.526 0 N-CA-C 108.139 -1.984 . . . . 0.0 108.139 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -65.69 -27.46 72.68 Favored Glycine 0 N--CA 1.482 1.703 0 N-CA-C 107.357 -2.297 . . . . 0.0 107.357 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -83.68 -44.81 18.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 34.1 mtm -46.96 -37.16 8.61 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -67.48 -65.67 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.347 0.594 . . . . 0.0 110.57 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -53.36 -53.38 51.9 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.391 -0.818 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -45.54 -59.24 2.83 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.723 -1.236 . . . . 0.0 109.687 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.726 HG22 ' CD2' ' A' ' 58' ' ' TRP . 85.1 t -54.25 -51.45 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.849 -1.157 . . . . 0.0 109.749 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -44.79 -40.22 5.92 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.355 -0.841 . . . . 0.0 110.145 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -68.21 -57.57 5.81 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.157 -0.964 . . . . 0.0 111.275 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.406 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.9 OUTLIER -62.11 -66.33 0.56 Allowed 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.82 -1.175 . . . . 0.0 109.014 -179.162 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.0 t70 72.38 82.54 0.14 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.928 0.871 . . . . 0.0 109.914 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.522 ' C ' ' H ' ' A' ' 56' ' ' LYS . 1.7 p -167.05 150.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.146 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.815 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -68.36 35.02 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.499 -0.75 . . . . 0.0 110.139 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.522 ' H ' ' C ' ' A' ' 54' ' ' VAL . 3.2 ttpm? -81.78 155.56 25.38 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.082 -1.011 . . . . 0.0 109.512 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -49.66 112.43 0.65 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.274 -0.891 . . . . 0.0 109.649 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.726 ' CD2' HG22 ' A' ' 49' ' ' VAL . 30.1 m95 -125.09 -30.31 3.22 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.562 -0.711 . . . . 0.0 110.045 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -56.6 13.72 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 120.914 -1.116 . . . . 0.0 110.797 -178.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -69.4 -4.0 16.62 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.106 -0.997 . . . . 0.0 110.396 -178.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.99 153.62 40.85 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.133 0.968 . . . . 0.0 110.676 -179.004 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -167.87 155.52 8.57 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.832 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.6 mm? -93.73 148.42 22.13 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.893 -1.13 . . . . 0.0 109.708 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.543 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.48 148.68 50.31 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.023 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.548 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -107.96 91.45 3.65 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.073 -1.017 . . . . 0.0 108.43 -178.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -55.23 -22.53 18.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.122 -0.986 . . . . 0.0 111.203 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.482 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -65.18 -18.61 65.45 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.177 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -123.95 -13.07 7.43 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.428 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.548 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.54 46.29 26.41 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 -177.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 t -113.49 -172.5 2.08 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.473 0.654 . . . . 0.0 109.851 -178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.475 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.64 104.38 8.35 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 177.672 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.446 ' HB3' HD13 ' A' ' 41' ' ' ILE . 46.2 mt -62.86 83.95 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.256 0 O-C-N 120.474 -1.391 . . . . 0.0 110.995 -176.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.475 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -119.02 6.73 11.32 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.482 ' O ' ' N ' ' A' ' 76' ' ' HIS . 5.9 mmpt? -76.36 32.76 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.653 HG23 ' H ' ' A' ' 42' ' ' GLY . 7.2 m -50.52 -10.08 0.06 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.102 -0.999 . . . . 0.0 109.661 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.482 ' N ' ' O ' ' A' ' 74' ' ' LYS . 21.4 t-80 -53.47 -65.93 0.48 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.233 -0.917 . . . . 0.0 109.265 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -85.73 -143.16 0.1 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.638 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -130.47 169.67 15.22 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.661 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -60.19 -50.34 74.04 Favored 'General case' 0 C--N 1.287 -2.142 0 O-C-N 121.327 -0.858 . . . . 0.0 109.952 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.453 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 19.9 t70 -43.89 -35.89 2.17 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-O 122.19 0.995 . . . . 0.0 109.124 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.638 ' CG ' ' H ' ' A' ' 78' ' ' THR . 44.5 mmtt -65.12 -51.35 61.76 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -44.89 95.71 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 115.14 37.29 1.13 Allowed Glycine 0 N--CA 1.511 3.695 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.404 HG22 HD21 ' A' ' 20' ' ' LEU . 56.8 mt -92.96 161.98 2.46 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -165.01 -166.03 0.97 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.259 -0.9 . . . . 0.0 109.465 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.92 -22.08 64.18 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.461 -0.774 . . . . 0.0 109.784 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -5.48 58.15 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.31 -0.869 . . . . 0.0 108.779 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.33 112.44 24.62 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.537 -0.727 . . . . 0.0 109.196 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -97.2 115.4 27.52 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.996 -1.065 . . . . 0.0 109.61 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.546 ' HG ' HD12 ' A' ' 20' ' ' LEU . 7.1 mt -93.42 176.18 6.48 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.543 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.0 mt-30 -135.19 157.15 47.66 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.476 ' CD2' ' C ' ' A' ' 92' ' ' PHE . 0.6 OUTLIER -105.76 131.86 52.6 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.365 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.052 0 O-C-N 120.95 -1.094 . . . . 0.0 109.196 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.6 m . . . . . 0 N--CA 1.488 1.447 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.68 134.68 57.32 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.808 -1.183 . . . . 0.0 110.216 -178.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.498 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.37 104.03 13.21 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.6 t -50.88 127.03 17.55 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 122.174 0.988 . . . . 0.0 109.668 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.59 -34.65 5.35 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 106.081 -2.807 . . . . 0.0 106.081 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -105.58 -35.94 7.27 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.07 56.39 6.61 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.73 1.252 . . . . 0.0 109.914 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -140.57 123.7 10.09 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -44.31 134.83 9.0 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 CA-C-N 120.446 1.195 . . . . 0.0 114.633 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.1 mt -93.9 98.41 8.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 557' ' ' THR . . . . . 0.409 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -99.54 91.26 4.82 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.258 -0.901 . . . . 0.0 111.208 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.46 -96.12 0.15 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 107.396 -2.282 . . . . 0.0 107.396 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.472 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.15 151.15 31.23 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.5 p -144.55 126.28 15.2 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.462 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.85 146.62 5.98 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.579 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 8.3 m -117.93 146.77 43.73 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.743 0.782 . . . . 0.0 109.041 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.51 -129.36 0.26 Allowed 'General case' 0 C--N 1.294 -1.814 0 CA-C-O 121.598 0.713 . . . . 0.0 109.228 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 4.0 mtt -65.84 26.27 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.33 -9.11 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -81.75 162.58 22.89 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.63 174.97 5.65 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.213 -1.402 . . . . 0.0 107.213 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.99 133.7 6.22 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 117.986 -1.486 . . . . 0.0 110.257 -178.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.594 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.7 m80 -54.32 115.17 7.88 Favored Pre-proline 0 C--N 1.304 -1.393 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 177.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.436 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 50.1 Cg_exo -45.38 -8.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 CA-C-N 120.278 1.135 . . . . 0.0 112.412 -178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.729 ' O ' HG13 ' B' ' 574' ' ' VAL . 8.5 mt-10 -104.11 -53.12 2.8 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 122.154 0.978 . . . . 0.0 109.757 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.516 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.6 m170 -54.73 -5.55 0.09 Allowed 'General case' 0 C--N 1.293 -1.86 0 O-C-N 120.431 -1.418 . . . . 0.0 109.734 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.491 ' H ' ' C ' ' B' ' 571' ' ' GLU . 15.9 t80 -125.45 53.46 1.54 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.729 HG13 ' O ' ' B' ' 571' ' ' GLU . 12.5 m -93.5 176.75 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.622 -0.674 . . . . 0.0 109.94 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.591 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.12 142.03 36.77 Favored 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.14 74.83 4.04 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 116.58 -2.048 . . . . 0.0 109.774 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.96 -57.87 0.15 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 101.655 -3.461 . . . . 0.0 101.655 172.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.552 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.1 p -122.39 78.48 1.51 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 111.922 -2.399 . . . . 0.0 104.738 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 0.631 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.8 mp -52.01 16.3 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -176.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.552 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.37 -37.42 21.56 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 119.476 -2.015 . . . . 0.0 112.328 -178.406 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.477 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.6 tp-100 -161.32 143.39 11.97 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 119.474 -2.016 . . . . 0.0 114.199 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.591 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.7 tp -138.95 170.69 15.53 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.452 ' O ' ' N ' ' B' ' 587' ' ' PHE . 69.0 m-20 -146.56 137.87 24.37 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.263 -0.898 . . . . 0.0 109.394 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.579 ' CE ' ' H ' ' B' ' 562' ' ' THR . 6.1 ptpp? -55.29 -22.43 18.67 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.582 0.706 . . . . 0.0 110.09 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.05 -17.06 59.96 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -131.18 23.56 4.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.967 -0.725 . . . . 0.0 109.344 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.538 ' O ' ' CG ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.7 113.02 25.0 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 122.235 1.017 . . . . 0.0 109.341 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -107.25 165.0 11.7 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 179.022 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.45 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.4 tt0 -152.13 156.99 40.93 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.719 1.247 . . . . 0.0 110.47 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.642 ' NE2' ' CE2' ' B' ' 600' ' ' PHE . 0.0 OUTLIER -160.96 146.55 14.44 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.456 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 48.37 22.82 0.5 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.749 -1.219 . . . . 0.0 109.425 -178.718 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.0 m-20 79.91 -6.38 1.77 Allowed 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.636 -0.665 . . . . 0.0 111.448 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 593' ' ' LYS . . . . . 0.52 ' O ' ' CE1' ' B' ' 595' ' ' TYR . 33.3 mttm -88.96 115.89 64.8 Favored Pre-proline 0 C--N 1.294 -1.832 0 O-C-N 121.064 -1.022 . . . . 0.0 110.121 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.562 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.0 Cg_exo -51.54 163.14 1.23 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 119.998 1.035 . . . . 0.0 112.369 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.562 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 66.4 m-85 -169.78 142.31 2.44 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.449 -0.782 . . . . 0.0 110.099 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 5.9 m -67.42 154.86 40.38 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -59.07 -58.01 10.54 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -48.29 -24.96 1.35 Allowed 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.629 -0.669 . . . . 0.0 110.025 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 599' ' ' CYS . . . . . 0.413 ' O ' ' HG ' ' B' ' 603' ' ' LEU . 1.4 m -77.08 -65.69 0.92 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.23 -0.919 . . . . 0.0 110.432 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.642 ' CE2' ' NE2' ' B' ' 590' ' ' GLN . 2.1 t80 -70.81 -40.49 72.45 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.848 -1.157 . . . . 0.0 111.261 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.687 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -52.11 -42.94 63.68 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.455 ' O ' HG21 ' A' ' 75' ' ' THR . 18.9 tptm -54.84 -25.33 27.83 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' B' ' 600' ' ' PHE . 11.6 mt -95.29 -57.95 2.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.477 -0.764 . . . . 0.0 111.652 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.494 ' CD1' ' CE2' ' B' ' 600' ' ' PHE . 13.0 m-85 -100.81 32.62 3.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.97 -1.082 . . . . 0.0 110.268 -179.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 109.698 179.526 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.123 0 N-CA-C 108.506 -1.838 . . . . 0.0 108.506 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 17' ' ' THR . 4.8 t -103.57 122.43 44.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.752 -0.852 . . . . 0.0 109.736 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.512 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -119.2 128.19 53.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.11 136.19 36.48 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.375 -0.828 . . . . 0.0 110.074 -179.392 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.492 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.45 132.78 34.16 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.319 -1.364 . . . . 0.0 107.319 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.96 145.49 36.03 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.788 -1.195 . . . . 0.0 108.234 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.9 t -140.46 115.96 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.719 0.771 . . . . 0.0 110.303 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -88.6 103.69 16.15 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.574 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -68.96 108.31 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.527 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.3 p -75.62 -55.94 5.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.274 -0.891 . . . . 0.0 110.566 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.546 ' CB ' ' NE2' ' A' ' 61' ' ' HIS . 25.6 t0 -58.24 1.06 0.06 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.039 -1.038 . . . . 0.0 109.824 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.6 mt -134.51 -25.09 1.52 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.341 -0.849 . . . . 0.0 109.433 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 24' ' ' VAL . 28.4 t-20 76.14 14.26 2.53 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.923 -0.486 . . . . 0.0 110.199 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -94.04 -178.07 4.52 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.871 -1.143 . . . . 0.0 109.836 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -136.76 119.12 15.71 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.448 HG12 ' N ' ' A' ' 32' ' ' THR . 23.1 t -122.54 157.8 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-O 121.658 0.742 . . . . 0.0 110.065 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.493 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.07 133.42 42.97 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -179.976 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.493 HD22 ' C ' ' A' ' 32' ' ' THR . 3.9 mm? -115.27 113.12 23.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.618 -0.676 . . . . 0.0 110.151 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.445 ' CA ' ' HE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -58.52 114.05 2.29 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.001 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.4 m -140.88 -170.2 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-O 121.967 0.889 . . . . 0.0 110.498 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.5 p -144.18 175.3 10.17 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.92 43.79 3.03 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.477 ' C ' HG21 ' A' ' 78' ' ' THR . 7.3 pt-20 -145.25 5.14 1.09 Allowed 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.573 ' O ' HG22 ' A' ' 78' ' ' THR . 2.6 m -89.97 136.81 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.015 -1.053 . . . . 0.0 109.993 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m-70 -75.31 141.87 43.33 Favored 'General case' 0 C--N 1.292 -1.924 0 O-C-N 120.96 -1.088 . . . . 0.0 108.232 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 32.3 mt -47.07 -57.99 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.001 -1.062 . . . . 0.0 109.654 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.554 ' H ' HG23 ' A' ' 75' ' ' THR . . . -54.05 -13.49 3.56 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 108.143 -1.983 . . . . 0.0 108.143 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.6 -28.89 64.52 Favored Glycine 0 N--CA 1.485 1.944 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.8 t -83.74 -39.01 14.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.458 ' O ' HG23 ' A' ' 49' ' ' VAL . 27.7 mtm -46.47 -39.88 11.43 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.623 HD12 HD13 ' B' ' 603' ' ' LEU . 0.4 OUTLIER -78.33 -58.1 3.43 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.52 -0.737 . . . . 0.0 110.535 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.41 ' CB ' HD12 ' A' ' 33' ' ' LEU . 39.0 mttm -47.89 -59.34 3.41 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.775 -1.203 . . . . 0.0 109.893 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 36.0 tp -45.75 -38.28 6.85 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.337 -0.852 . . . . 0.0 109.391 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 45' ' ' MET . 81.4 t -78.37 -42.39 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.155 -0.966 . . . . 0.0 109.403 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.429 ' O ' ' OD1' ' A' ' 53' ' ' ASP . 39.5 mm-40 -46.54 -39.92 11.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.272 -0.892 . . . . 0.0 109.276 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.485 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.0 mtmp? -74.78 -34.01 62.37 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.52 -69.02 0.51 Allowed 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 50' ' ' GLU . 91.2 m-20 52.8 68.09 0.89 Allowed 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.17 0.509 . . . . 0.0 109.725 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.618 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.7 OUTLIER -136.42 32.06 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 122.0 0.905 . . . . 0.0 109.927 -178.775 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.42 ' HG3' HD12 ' B' ' 579' ' ' LEU . 24.1 tptt 41.66 19.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.732 -0.605 . . . . 0.0 110.647 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.537 ' N ' ' O ' ' A' ' 54' ' ' VAL . 28.3 ttmt -75.65 151.37 37.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.826 -1.171 . . . . 0.0 107.939 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.46 ' OD1' ' N ' ' A' ' 57' ' ' ASP . 0.7 OUTLIER -53.59 89.78 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.405 -0.809 . . . . 0.0 108.925 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.528 ' N ' ' O ' ' A' ' 56' ' ' LYS . 10.7 m0 -78.3 -43.47 27.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.514 ' C ' ' H ' ' A' ' 61' ' ' HIS . 32.2 t -54.2 -48.69 70.72 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.609 -0.682 . . . . 0.0 109.249 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -59.59 -1.41 0.24 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.387 -0.82 . . . . 0.0 109.16 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.546 ' NE2' ' CB ' ' A' ' 26' ' ' ASP . 14.9 m80 -123.18 147.93 46.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.619 -0.676 . . . . 0.0 109.477 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.532 ' H ' ' C ' ' A' ' 93' ' ' THR . . . -156.38 179.35 9.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.384 -0.822 . . . . 0.0 108.828 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.721 HD22 ' N ' ' A' ' 63' ' ' LEU . 2.9 mm? -94.92 140.43 29.95 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.02 -1.05 . . . . 0.0 110.502 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.516 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -134.67 146.6 49.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.5 t90 -105.82 91.34 3.7 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.938 -1.101 . . . . 0.0 108.751 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 9.7 pt-20 -55.92 -22.52 26.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.968 . . . . 0.0 110.811 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -64.9 -18.09 64.9 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 178.07 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -125.45 -11.37 6.84 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.303 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.2 mpp_? 53.34 47.38 24.34 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 -178.263 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -115.14 -170.75 1.82 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.45 0.643 . . . . 0.0 110.033 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -124.28 99.83 6.41 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 177.081 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.0 86.5 0.01 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.676 -1.265 . . . . 0.0 110.895 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.1 pp -121.35 4.33 10.26 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.514 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -69.82 35.09 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.062 -1.024 . . . . 0.0 109.306 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.554 HG23 ' H ' ' A' ' 42' ' ' GLY . 21.8 m -51.73 -7.18 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.684 -1.26 . . . . 0.0 109.849 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.514 ' H ' ' C ' ' A' ' 74' ' ' LYS . 1.1 t60 -50.31 -73.14 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.183 -0.948 . . . . 0.0 110.2 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -90.64 -112.43 0.08 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.083 -1.011 . . . . 0.0 109.961 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -152.83 -163.39 1.7 Allowed 'General case' 0 N--CA 1.504 2.233 0 O-C-N 119.563 -1.961 . . . . 0.0 111.445 -178.97 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.597 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.8 mp -70.51 -57.27 4.94 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -42.68 -45.68 4.79 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.127 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.511 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -83.18 -47.94 11.04 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.38 7.17 12.56 Favored Glycine 0 N--CA 1.501 3.012 0 N-CA-C 108.547 -1.821 . . . . 0.0 108.547 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 36.9 mt -61.15 160.49 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.497 ' HA ' ' CZ3' ' A' ' 18' ' ' TRP . 1.0 OUTLIER -154.15 -164.42 1.85 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 108.986 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -75.25 -17.28 60.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.348 -0.845 . . . . 0.0 109.772 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.06 3.85 50.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.492 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.02 113.34 25.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.284 -0.885 . . . . 0.0 108.981 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -96.03 123.63 39.72 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.001 -1.062 . . . . 0.0 109.994 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.474 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.6 mt -106.46 177.94 4.71 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.771 0.795 . . . . 0.0 109.123 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.516 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 6.0 mt-30 -131.87 165.36 24.04 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -117.05 91.34 3.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.532 ' C ' ' H ' ' A' ' 62' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.67 135.58 57.68 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 120.949 -1.094 . . . . 0.0 110.259 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.517 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.38 103.5 12.79 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.41 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.3 t -50.22 126.1 13.99 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-O 122.153 0.978 . . . . 0.0 109.628 -177.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.17 5.6 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 106.304 -2.718 . . . . 0.0 106.304 -177.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.1 m -105.94 -35.82 7.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.16 56.22 6.74 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 122.658 1.218 . . . . 0.0 110.004 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp -140.79 124.21 10.13 Favored Pre-proline 0 C--N 1.293 -1.853 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -44.38 136.05 8.69 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.447 1.195 . . . . 0.0 114.612 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.0 mt -95.37 98.26 7.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.6 p -100.11 90.72 4.47 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.259 -0.901 . . . . 0.0 111.169 -177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.01 -95.87 0.15 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.405 -2.278 . . . . 0.0 107.405 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.458 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.5 mmt180 -113.15 149.52 33.48 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.34 126.36 15.47 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.984 -1.073 . . . . 0.0 111.455 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 561' ' ' ILE . . . . . 0.519 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 48.9 mt -91.14 146.86 5.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.691 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.9 m -117.28 146.96 42.98 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.766 0.793 . . . . 0.0 109.131 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.67 -129.3 0.26 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.551 0.691 . . . . 0.0 109.401 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.55 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.2 mtt -65.78 26.26 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.2 -8.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 -178.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -81.42 164.45 22.06 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -106.94 174.5 5.86 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.88 137.57 8.72 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.104 -1.438 . . . . 0.0 110.005 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.603 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.3 m80 -57.11 116.01 12.23 Favored Pre-proline 0 C--N 1.3 -1.574 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 177.054 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.438 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 50.9 Cg_exo -43.9 -9.38 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.391 0 CA-C-N 120.129 1.082 . . . . 0.0 112.755 -178.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.915 ' O ' HG13 ' B' ' 574' ' ' VAL . 6.9 mt-10 -105.26 -52.85 2.76 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.197 -0.939 . . . . 0.0 110.037 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.508 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 13.3 m170 -55.79 -4.97 0.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.822 -1.174 . . . . 0.0 109.75 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.469 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.2 t80 -122.26 52.15 1.32 Allowed 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.915 HG13 ' O ' ' B' ' 571' ' ' GLU . 18.7 m -92.53 177.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.396 0 CA-C-O 121.58 0.705 . . . . 0.0 109.218 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.667 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.74 145.83 32.68 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.476 -0.765 . . . . 0.0 109.088 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 576' ' ' ALA . . . . . 0.464 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -93.55 77.16 4.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 117.019 -1.873 . . . . 0.0 108.809 178.023 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 577' ' ' PHE . . . . . 0.424 ' HE2' ' HG ' ' A' ' 59' ' ' SER . 85.4 t80 -151.28 -45.96 0.11 Allowed 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 101.802 -3.407 . . . . 0.0 101.802 174.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.8 OUTLIER -126.83 154.98 43.61 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 111.677 -2.511 . . . . 0.0 105.314 177.559 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 1.108 ' H ' HD22 ' B' ' 579' ' ' LEU . 0.0 OUTLIER -104.74 14.32 29.89 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.659 -1.276 . . . . 0.0 111.281 -178.288 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.557 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -100.28 -39.25 8.12 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-N 120.909 1.686 . . . . 0.0 115.502 -176.181 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.4 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.3 tp-100 -162.57 142.44 9.48 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 122.29 2.314 . . . . 0.0 115.846 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.667 HD13 ' HB2' ' B' ' 575' ' ' CYS . 24.2 tp -136.91 169.75 17.24 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 174.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.446 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.0 m-20 -147.32 129.66 15.73 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.992 -1.067 . . . . 0.0 109.299 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.691 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.0 ptpp? -51.17 -17.72 0.73 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.539 -0.726 . . . . 0.0 109.753 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.29 -20.81 51.28 Favored Glycine 0 N--CA 1.487 2.072 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.3 p -133.88 28.11 3.89 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.582 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.6 OUTLIER -89.64 106.98 18.82 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.736 1.255 . . . . 0.0 109.836 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.72 167.71 10.61 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 179.486 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -152.08 157.27 41.39 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 122.634 1.207 . . . . 0.0 110.721 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.546 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 2.1 tp60 -154.87 146.12 22.88 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.519 HD21 ' HG3' ' B' ' 593' ' ' LYS . 0.3 OUTLIER 45.24 23.89 0.13 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.969 -1.082 . . . . 0.0 110.111 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.483 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.5 m-20 81.66 -4.9 1.57 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.598 -0.689 . . . . 0.0 110.809 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 593' ' ' LYS . . . . . 0.519 ' HG3' HD21 ' B' ' 591' ' ' ASN . 33.8 mttm -89.15 121.69 69.33 Favored Pre-proline 0 C--N 1.294 -1.827 0 O-C-N 121.296 -0.878 . . . . 0.0 109.457 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.48 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.7 Cg_exo -48.71 164.82 0.2 Allowed 'Trans proline' 0 N--CA 1.489 1.227 0 CA-C-N 119.945 1.016 . . . . 0.0 111.809 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.2 m-85 -170.51 141.48 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.626 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 596' ' ' CYS . . . . . 0.507 ' HG ' ' CB ' ' B' ' 575' ' ' CYS . 20.6 m -76.16 155.74 34.32 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 104.455 -2.424 . . . . 0.0 104.455 174.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -60.77 -57.82 11.08 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 117.293 -1.763 . . . . 0.0 106.383 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.03 -29.09 1.34 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.503 -0.748 . . . . 0.0 109.359 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.8 m -80.89 -64.82 1.11 Allowed 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -53.35 -53.37 52.08 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.672 -0.642 . . . . 0.0 109.988 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.69 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -48.52 -42.34 32.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.092 -1.005 . . . . 0.0 108.776 -179.167 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 26.3 tptt -61.36 -20.4 62.95 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.38 -0.825 . . . . 0.0 110.26 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.623 HD13 HD12 ' A' ' 46' ' ' LEU . 7.7 mt -91.68 -56.29 3.16 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.69 -1.257 . . . . 0.0 110.409 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.546 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 3.8 m-85 -93.16 9.3 36.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.991 -1.068 . . . . 0.0 109.618 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.485 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 12.0 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.302 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.529 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.488 2.147 0 N-CA-C 107.558 -2.217 . . . . 0.0 107.558 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 p -75.66 121.92 23.2 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.006 0.908 . . . . 0.0 110.726 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -141.35 124.07 16.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 178.676 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.628 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.87 130.97 40.98 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.59 -1.319 . . . . 0.0 109.872 -179.173 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.478 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.55 130.68 34.71 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 179.107 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.78 146.15 33.95 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.331 -0.855 . . . . 0.0 109.818 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.515 HG21 ' CE2' ' A' ' 92' ' ' PHE . 25.1 t -132.4 156.82 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-O 122.388 1.09 . . . . 0.0 110.042 178.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.538 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 15.7 m80 -128.42 98.91 5.21 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 104.195 -2.521 . . . . 0.0 104.195 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.56 ' O ' ' N ' ' A' ' 28' ' ' ASN . 9.0 t -73.15 94.35 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 C-N-CA 119.026 -1.07 . . . . 0.0 109.149 -178.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.491 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -64.99 169.08 5.64 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.742 -1.206 . . . . 0.0 107.742 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 0.9 OUTLIER 73.01 -45.52 0.62 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 25' ' ' THR . 9.1 tp -92.15 -32.62 15.05 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.56 ' N ' ' O ' ' A' ' 24' ' ' VAL . 31.3 t-20 73.05 9.91 5.32 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.447 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.433 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 60.0 mtp180 -87.03 -179.79 6.54 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 120.53 -1.356 . . . . 0.0 108.947 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.538 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 1.0 OUTLIER -143.04 123.05 13.57 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.875 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.6 t -127.69 158.64 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 CA-C-O 121.415 0.626 . . . . 0.0 110.771 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -123.34 139.95 53.52 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 32' ' ' THR . 2.2 mm? -119.73 113.33 20.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.536 -0.727 . . . . 0.0 109.89 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -60.41 104.35 0.32 Allowed 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.5 m -129.17 -169.03 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 122.01 0.909 . . . . 0.0 110.566 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.1 p -143.39 166.32 25.09 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.486 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -76.84 48.08 2.61 Favored Glycine 0 N--CA 1.485 1.937 0 C-N-CA 119.133 -1.508 . . . . 0.0 109.572 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.435 ' C ' HG21 ' A' ' 78' ' ' THR . 1.1 pp20? -153.59 2.43 0.27 Allowed 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.641 -0.917 . . . . 0.0 109.172 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 m -81.33 139.62 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 120.892 -1.13 . . . . 0.0 109.187 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.45 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m80 -79.09 140.74 37.78 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.462 HD13 ' HB3' ' A' ' 72' ' ' LEU . 74.3 mt -46.9 -57.31 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.156 -0.965 . . . . 0.0 109.476 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.77 -10.26 8.15 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.399 -1.481 . . . . 0.0 109.399 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -80.69 -24.26 58.68 Favored Glycine 0 N--CA 1.481 1.671 0 N-CA-C 106.51 -2.636 . . . . 0.0 106.51 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 45' ' ' MET . 0.4 OUTLIER -73.48 -55.65 11.89 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 114.681 -0.759 . . . . 0.0 109.094 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.534 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 39.7 mtm -46.22 -32.04 2.81 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.26 -0.9 . . . . 0.0 108.942 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.436 HD12 HD13 ' B' ' 603' ' ' LEU . 3.2 tt -71.65 -28.9 64.07 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.12 -179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -88.82 -59.26 2.28 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.125 -1.609 . . . . 0.0 111.748 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.61 HD13 ' CZ ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -45.69 -55.78 6.03 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.762 -1.211 . . . . 0.0 109.001 -178.588 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 72.7 t -51.81 -50.82 31.06 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 C-N-CA 119.931 -0.708 . . . . 0.0 109.875 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -47.68 -41.13 21.81 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.914 -1.116 . . . . 0.0 109.566 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -68.11 -38.45 82.28 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.289 -0.882 . . . . 0.0 109.861 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.422 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -66.51 -69.44 0.3 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.17 -0.956 . . . . 0.0 108.829 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.422 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 7.7 t70 75.07 83.29 0.1 Allowed 'General case' 0 N--CA 1.488 1.438 0 CA-C-O 121.977 0.894 . . . . 0.0 109.977 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.519 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.0 p -168.77 150.89 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.977 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.63 27.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.524 -0.735 . . . . 0.0 109.448 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.519 ' H ' ' C ' ' A' ' 54' ' ' VAL . 9.0 ttpp -78.75 147.36 33.41 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.902 -1.124 . . . . 0.0 109.634 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -69.48 112.53 6.07 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.543 -0.723 . . . . 0.0 109.249 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.536 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 79.3 m95 -108.39 -42.78 4.49 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.462 -0.774 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.8 t -45.45 -55.09 6.51 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 109.643 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -51.03 -33.98 27.67 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.537 ' CG ' ' O ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -71.41 115.46 10.61 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 121.943 0.878 . . . . 0.0 109.261 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -121.15 164.28 17.13 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.878 HD22 ' H ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -93.87 141.16 28.83 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.882 -1.136 . . . . 0.0 110.97 -177.893 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.511 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.34 140.99 51.57 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -101.85 91.84 4.55 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 17.0 pt-20 -55.56 -21.99 19.69 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.122 -0.986 . . . . 0.0 111.005 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.488 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -65.62 -19.38 65.89 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 105.647 -1.982 . . . . 0.0 105.647 178.154 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -123.22 -12.66 7.84 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.441 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 53.9 45.36 27.91 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -177.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -112.64 -173.93 2.35 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.492 0.663 . . . . 0.0 110.032 -178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.33 5.59 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.602 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.462 ' HB3' HD13 ' A' ' 41' ' ' ILE . 15.8 mt -62.05 84.1 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.122 0 O-C-N 120.231 -1.543 . . . . 0.0 110.278 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -113.6 14.02 18.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.565 ' NZ ' ' CZ ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -85.48 66.44 9.68 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.807 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.61 HG21 ' O ' ' B' ' 602' ' ' LYS . 1.9 m -64.99 -6.7 9.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.0 109.776 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -84.43 -35.82 22.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.164 -0.96 . . . . 0.0 110.07 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.0 m95 -91.65 -160.25 0.71 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.115 -0.991 . . . . 0.0 109.505 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.658 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -150.01 169.18 21.81 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 122.086 0.946 . . . . 0.0 109.238 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.527 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 9.1 mp -43.65 -63.81 0.77 Allowed 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.994 0.902 . . . . 0.0 109.257 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -43.01 -51.37 5.71 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.875 0.845 . . . . 0.0 110.075 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.658 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -45.44 -53.92 8.09 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-O 121.617 0.723 . . . . 0.0 109.794 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.565 ' CZ ' ' NZ ' ' A' ' 74' ' ' LYS . 10.5 m-85 -77.33 -40.21 44.98 Favored 'General case' 0 C--N 1.298 -1.653 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.524 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.21 10.47 10.75 Favored Glycine 0 N--CA 1.5 2.952 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.447 HG22 ' N ' ' A' ' 85' ' ' GLN . 55.4 mt -61.09 160.19 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 O-C-N 121.537 -0.978 . . . . 0.0 108.937 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.447 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.5 tp60 -171.83 -167.13 0.47 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.364 -0.835 . . . . 0.0 109.359 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.63 -23.79 66.22 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 110.169 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -78.51 -8.03 58.12 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.237 -0.914 . . . . 0.0 108.673 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.69 26.23 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.5 mmtp -93.17 119.92 32.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.992 -1.067 . . . . 0.0 109.067 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.7 mt -99.32 176.03 5.67 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 121.795 0.807 . . . . 0.0 110.5 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.511 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.1 mt-30 -133.63 147.44 51.47 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.677 ' CD2' HD12 ' A' ' 63' ' ' LEU . 4.2 m-85 -113.27 97.64 6.61 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.761 0 O-C-N 121.298 -0.876 . . . . 0.0 111.28 -177.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m . . . . . 0 N--CA 1.488 1.431 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.69 135.66 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.883 -1.135 . . . . 0.0 110.271 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.506 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.62 103.93 13.34 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 105.811 -1.922 . . . . 0.0 105.811 178.2 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.7 t -50.62 126.79 16.41 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.124 0.964 . . . . 0.0 109.727 -177.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.92 5.17 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 106.208 -2.757 . . . . 0.0 106.208 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.34 -35.85 7.39 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.68 56.4 6.2 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 122.656 1.217 . . . . 0.0 110.138 -178.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -140.49 123.45 10.03 Favored Pre-proline 0 C--N 1.293 -1.865 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -44.29 134.99 8.9 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 120.534 1.227 . . . . 0.0 114.485 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.5 mt -93.92 98.2 7.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 24.7 p -100.07 91.13 4.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.228 -0.92 . . . . 0.0 111.333 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.17 -97.07 0.16 Allowed Glycine 0 N--CA 1.486 2.028 0 N-CA-C 107.063 -2.415 . . . . 0.0 107.063 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.464 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 0.9 OUTLIER -111.94 150.64 30.23 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 177.878 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.32 125.78 14.89 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.227 1.013 . . . . 0.0 111.411 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 561' ' ' ILE . . . . . 0.608 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 47.0 mt -91.09 147.41 5.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.691 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 8.7 m -118.14 146.93 43.8 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 121.786 0.803 . . . . 0.0 109.072 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.725 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.22 -129.14 0.26 Allowed 'General case' 0 C--N 1.295 -1.768 0 CA-C-O 121.593 0.711 . . . . 0.0 109.359 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.6 mtt -65.65 26.28 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.725 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.21 -9.16 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -178.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -82.28 162.17 22.38 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -103.9 174.31 5.93 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -159.75 138.55 10.75 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 118.211 -1.395 . . . . 0.0 109.861 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.605 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.6 m80 -57.89 116.99 16.22 Favored Pre-proline 0 C--N 1.299 -1.63 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.425 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 53.1 Cg_exo -45.38 -9.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.403 0 CA-C-N 120.33 1.154 . . . . 0.0 111.793 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.921 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.9 mt-10 -100.02 -52.33 3.45 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.155 0.979 . . . . 0.0 109.977 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.445 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 22.0 m170 -58.21 -3.35 0.25 Allowed 'General case' 0 C--N 1.293 -1.884 0 O-C-N 120.696 -1.252 . . . . 0.0 109.9 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 31.2 t80 -127.68 57.53 1.52 Allowed 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.921 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.48 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.717 0.77 . . . . 0.0 111.403 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.619 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.86 146.12 35.86 Favored 'General case' 0 N--CA 1.504 2.266 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.803 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.36 74.69 3.33 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 116.623 -2.031 . . . . 0.0 109.974 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -63.66 0.14 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 101.962 -3.347 . . . . 0.0 101.962 172.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.2 p -114.22 80.42 1.39 Allowed 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 112.356 -2.202 . . . . 0.0 105.108 176.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.2 16.99 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 -176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.05 -36.23 17.08 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 119.687 -1.883 . . . . 0.0 112.691 -178.606 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -159.47 139.59 11.9 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 119.295 -2.128 . . . . 0.0 115.138 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.619 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.2 tp -141.33 168.83 18.85 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.43 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 63.9 m-20 -148.25 140.24 23.99 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -0.965 . . . . 0.0 109.092 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.691 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.6 ptpp? -57.6 -19.65 27.35 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.394 -0.816 . . . . 0.0 109.636 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.3 -17.22 57.72 Favored Glycine 0 N--CA 1.485 1.96 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.11 25.35 4.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.943 -0.739 . . . . 0.0 109.422 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.519 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.12 114.45 26.39 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-O 122.283 1.04 . . . . 0.0 109.408 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -106.16 167.1 10.04 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 179.074 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.7 tt0 -153.48 157.54 40.0 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.618 -1.301 . . . . 0.0 111.323 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.5 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 1.2 tp-100 -156.81 146.21 20.5 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 178.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.479 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 47.07 23.55 0.3 Allowed 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.939 -1.101 . . . . 0.0 109.609 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.9 m-20 81.51 -6.0 1.54 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.759 -0.588 . . . . 0.0 110.973 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -88.17 118.1 69.17 Favored Pre-proline 0 C--N 1.295 -1.789 0 O-C-N 121.16 -0.963 . . . . 0.0 110.005 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.542 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.1 Cg_exo -49.87 164.45 0.4 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 CA-C-N 119.988 1.031 . . . . 0.0 111.855 179.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.542 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.73 137.98 1.36 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.276 -0.89 . . . . 0.0 109.877 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.06 156.6 35.66 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -61.61 -56.4 20.24 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.46 -28.63 0.94 Allowed 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 21.1 m -84.14 -65.88 0.96 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.449 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.7 OUTLIER -45.6 -52.29 10.83 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.594 0.712 . . . . 0.0 109.583 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.64 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -59.9 -40.95 90.51 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.574 -0.704 . . . . 0.0 109.393 -178.489 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.61 ' O ' HG21 ' A' ' 75' ' ' THR . 17.4 tptm -57.46 -26.27 60.97 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.157 -0.965 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.518 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -93.73 -56.66 2.82 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.028 -1.045 . . . . 0.0 111.123 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.5 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 0.3 OUTLIER -100.5 -29.62 12.26 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.178 -0.951 . . . . 0.0 110.727 -178.112 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.439 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 2.4 t . . . . . 0 N--CA 1.501 2.102 0 O-C-N 121.048 -1.033 . . . . 0.0 109.682 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.699 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -90.19 122.53 33.21 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.454 -1.027 . . . . 0.0 109.544 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.65 121.44 32.15 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.606 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.7 128.73 35.82 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.073 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.484 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -83.45 135.03 34.83 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.246 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.07 145.85 35.58 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.399 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.7 t -137.81 111.07 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 CA-C-O 121.923 0.868 . . . . 0.0 109.756 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.514 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 6.9 m-70 -85.8 103.59 14.71 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.1 t -73.03 82.8 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 O-C-N 121.159 -0.963 . . . . 0.0 109.192 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.62 166.4 0.93 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.77 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.5 t0 73.48 -46.3 0.63 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.575 HD12 ' HD2' ' A' ' 29' ' ' ARG . 0.3 OUTLIER -85.76 -36.34 20.2 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.345 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 24' ' ' VAL . 33.0 t-20 75.72 13.28 2.91 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.339 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.575 ' HD2' HD12 ' A' ' 27' ' ' LEU . 43.5 mtp180 -90.41 -177.81 5.18 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.12 -0.988 . . . . 0.0 109.144 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.514 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 18.1 m-20 -144.45 116.87 8.54 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 32' ' ' THR . 19.9 t -119.41 157.4 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.693 0.759 . . . . 0.0 110.062 -178.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.424 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.12 133.01 42.34 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.424 HD22 ' C ' ' A' ' 32' ' ' THR . 2.7 mm? -113.84 113.24 24.63 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.705 -0.622 . . . . 0.0 109.334 -179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -59.95 105.95 0.45 Allowed 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' HG11 ' A' ' 39' ' ' VAL . 18.1 m -134.25 -169.51 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-O 121.988 0.899 . . . . 0.0 110.4 -178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.3 p -142.5 174.64 10.45 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.09 44.65 2.65 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.452 ' C ' HG21 ' A' ' 78' ' ' THR . 0.0 OUTLIER -145.58 4.07 1.01 Allowed 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.602 -0.94 . . . . 0.0 108.956 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.597 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -88.9 137.72 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.073 -1.017 . . . . 0.0 110.193 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.482 ' O ' ' N ' ' A' ' 43' ' ' GLY . 3.8 m-70 -79.25 144.38 34.39 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.138 -0.976 . . . . 0.0 108.912 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 87.9 mt -45.74 -58.54 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.257 -0.902 . . . . 0.0 110.175 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.07 -13.58 4.93 Favored Glycine 0 C--N 1.296 -1.677 0 N-CA-C 108.734 -1.746 . . . . 0.0 108.734 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.95 -26.33 58.47 Favored Glycine 0 N--CA 1.48 1.621 0 N-CA-C 108.54 -1.824 . . . . 0.0 108.54 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -83.32 -53.95 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.469 -1.018 . . . . 0.0 110.642 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -27.68 44.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.222 -1.549 . . . . 0.0 108.862 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -64.13 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -52.28 -53.99 37.07 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.431 -0.793 . . . . 0.0 110.17 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.5 tp -44.93 -51.52 9.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.508 -0.745 . . . . 0.0 110.098 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.81 -47.13 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.815 -1.178 . . . . 0.0 109.008 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -48.03 -40.62 23.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.275 -0.891 . . . . 0.0 109.474 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -69.21 -43.87 73.23 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.406 -0.809 . . . . 0.0 110.011 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -48.96 -58.1 5.43 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.566 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.4 t70 74.0 75.47 0.12 Allowed 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.938 0.875 . . . . 0.0 110.135 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.493 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -175.16 132.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.292 -1.905 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.593 ' HB3' HD21 ' B' ' 579' ' ' LEU . 7.1 mmtt -69.46 35.86 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.458 -0.776 . . . . 0.0 109.381 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.539 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 39.4 tttp -78.95 135.42 36.94 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.628 -1.295 . . . . 0.0 108.681 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.406 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 14.3 t70 -50.02 119.72 3.83 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.223 -0.923 . . . . 0.0 108.958 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 55.1 m95 -120.23 -35.93 3.34 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.58 -0.7 . . . . 0.0 110.539 -179.343 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 58' ' ' TRP . 8.2 t -43.15 -50.27 6.28 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.293 -0.879 . . . . 0.0 109.164 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -55.52 -43.06 75.38 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.603 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.4 OUTLIER -71.16 115.15 9.97 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.582 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -129.56 168.99 15.58 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.624 ' O ' HD12 ' A' ' 63' ' ' LEU . 0.3 OUTLIER -95.71 149.37 21.55 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 122.289 1.042 . . . . 0.0 110.679 -178.905 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.623 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -141.6 142.87 33.46 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 -178.71 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.696 ' HB2' HD21 ' A' ' 72' ' ' LEU . 5.1 t90 -94.96 90.8 6.1 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.292 -1.505 . . . . 0.0 108.955 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.416 ' C ' ' N ' ' A' ' 68' ' ' LYS . 14.3 pt-20 -55.44 -23.46 25.41 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.069 -1.019 . . . . 0.0 110.585 -179.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.483 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 12.6 mmtp -66.53 -10.4 44.57 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.416 ' N ' ' C ' ' A' ' 66' ' ' GLU . 17.7 mmtt -133.29 -11.08 2.87 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.616 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.3 mpp_? 52.73 47.18 25.24 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 4.0 t -115.43 -172.15 2.09 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.472 0.653 . . . . 0.0 109.834 -178.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.56 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.8 99.21 5.04 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 177.02 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.696 HD21 ' HB2' ' A' ' 65' ' ' TRP . 0.5 OUTLIER -62.38 87.72 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.182 0 O-C-N 120.667 -1.271 . . . . 0.0 108.832 -176.931 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 13.01 12.55 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.96 74.72 9.67 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -25.22 68.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.909 -1.12 . . . . 0.0 108.354 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.48 ' O ' ' CE3' ' A' ' 77' ' ' TRP . 2.8 t60 -82.83 73.71 9.84 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.48 ' CE3' ' O ' ' A' ' 76' ' ' HIS . 0.1 OUTLIER 161.04 -167.77 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 -179.144 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.68 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -149.44 -172.0 4.03 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.776 -1.202 . . . . 0.0 109.432 -179.756 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -62.49 -58.82 6.24 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -42.95 -50.98 5.77 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.695 0.76 . . . . 0.0 109.874 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.68 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -46.54 -54.39 9.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-O 121.58 0.705 . . . . 0.0 109.684 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -73.71 -41.11 63.04 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.117 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 114.11 8.8 16.83 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 108.131 -1.988 . . . . 0.0 108.131 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 58.9 mt -61.07 157.94 2.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.755 -0.85 . . . . 0.0 109.135 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -164.16 -165.78 1.04 Allowed 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.61 -24.85 63.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.468 -0.77 . . . . 0.0 110.022 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.4 p30 -78.6 -7.98 58.15 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 108.769 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.61 26.12 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.0 mmtp -93.82 116.02 28.46 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.982 -1.074 . . . . 0.0 110.018 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.484 ' HG ' HD12 ' A' ' 20' ' ' LEU . 12.2 mt -91.16 176.65 6.51 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 178.521 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.623 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.9 mt-30 -135.6 171.73 14.03 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.54 97.62 3.19 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.417 ' CB ' ' OG1' ' A' ' 25' ' ' THR . 3.0 t . . . . . 0 N--CA 1.491 1.582 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.85 -177.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.531 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.0 m . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.86 136.39 57.96 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.407 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.489 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.61 103.9 13.3 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.245 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -51.1 126.96 17.83 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.198 0.999 . . . . 0.0 109.641 -177.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -34.56 5.42 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.172 -2.771 . . . . 0.0 106.172 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.73 -35.47 7.36 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 178.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.08 56.22 6.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 122.742 1.258 . . . . 0.0 110.025 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -141.02 125.02 10.31 Favored Pre-proline 0 C--N 1.293 -1.856 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -44.24 137.65 7.5 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 120.372 1.169 . . . . 0.0 114.993 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.531 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.8 mt -96.58 98.72 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.007 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 71.8 p -99.84 93.41 5.78 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.234 -0.916 . . . . 0.0 111.356 -177.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 153.25 -95.4 0.15 Allowed Glycine 0 N--CA 1.487 2.082 0 N-CA-C 107.406 -2.278 . . . . 0.0 107.406 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.477 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.29 152.48 31.3 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.1 p -144.48 126.19 15.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.012 -1.055 . . . . 0.0 111.265 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.8 mt -90.6 146.5 6.12 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.78 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.8 m -118.51 146.74 44.3 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 121.888 0.852 . . . . 0.0 109.049 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.85 -129.0 0.25 Allowed 'General case' 0 C--N 1.295 -1.79 0 CA-C-O 121.607 0.718 . . . . 0.0 109.407 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 14.1 mtp -65.57 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.02 -8.75 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -178.074 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -81.84 159.93 23.62 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt -102.91 174.47 5.86 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.69 136.18 8.01 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.231 -1.388 . . . . 0.0 109.957 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.588 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.79 115.81 10.52 Favored Pre-proline 0 C--N 1.3 -1.567 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 177.098 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.435 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 47.7 Cg_exo -46.22 -8.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.452 0 CA-C-N 120.353 1.162 . . . . 0.0 111.814 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.921 ' O ' HG13 ' B' ' 574' ' ' VAL . 12.2 mt-10 -100.64 -52.84 3.23 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.021 0.915 . . . . 0.0 110.06 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.523 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.2 m170 -57.03 -4.7 0.19 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.848 -1.157 . . . . 0.0 109.863 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.457 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.6 t80 -124.77 54.53 1.4 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 178.198 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.921 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -93.74 177.6 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.827 0.823 . . . . 0.0 110.738 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.588 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -76.9 149.33 36.07 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -96.35 76.07 2.95 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 116.787 -1.965 . . . . 0.0 110.736 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.84 -56.97 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 172.054 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.8 p -117.21 121.99 42.74 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 112.535 -2.121 . . . . 0.0 106.772 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 55' ' ' LYS . 10.8 mp -75.01 14.19 0.56 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 121.05 -1.031 . . . . 0.0 111.981 -177.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -92.27 -39.5 11.48 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 119.361 -2.087 . . . . 0.0 115.277 -175.802 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.403 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.2 tp-100 -162.72 141.57 8.79 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 122.513 2.415 . . . . 0.0 116.332 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.7 tp -142.04 168.69 19.15 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 174.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.504 ' O ' ' N ' ' B' ' 587' ' ' PHE . 72.2 m-20 -149.82 135.86 18.76 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.917 -1.114 . . . . 0.0 109.048 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.78 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 1.2 ptpp? -54.87 -14.37 1.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.21 -0.931 . . . . 0.0 109.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 585' ' ' GLY . . . . . 0.408 ' N ' ' C ' ' B' ' 583' ' ' ASN . . . -94.72 -15.5 45.93 Favored Glycine 0 N--CA 1.486 2.019 0 N-CA-C 108.735 -1.746 . . . . 0.0 108.735 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.1 p -136.72 26.17 3.07 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.907 -0.76 . . . . 0.0 108.983 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 2.2 p90 -89.25 108.18 19.47 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 122.446 1.117 . . . . 0.0 109.338 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.56 165.63 11.53 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.429 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -153.2 157.29 40.02 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 122.656 1.217 . . . . 0.0 110.718 -178.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.429 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 1.8 tp60 -156.56 145.96 20.62 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.48 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 46.79 23.58 0.27 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.037 -1.039 . . . . 0.0 109.497 -179.642 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.48 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 82.55 -7.19 1.29 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.818 -0.551 . . . . 0.0 110.865 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -87.83 116.45 66.2 Favored Pre-proline 0 C--N 1.295 -1.763 0 O-C-N 121.123 -0.986 . . . . 0.0 110.067 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.3 Cg_exo -50.26 164.34 0.49 Allowed 'Trans proline' 0 N--CA 1.488 1.176 0 CA-C-N 120.026 1.045 . . . . 0.0 111.698 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 24.2 m-85 -170.4 140.5 1.83 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.259 -0.901 . . . . 0.0 109.837 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.7 m -69.63 154.72 41.59 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 175.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -58.7 -56.97 15.34 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.31 -30.04 1.9 Allowed 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 6.6 m -81.24 -63.14 1.46 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.554 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.48 -54.34 28.07 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.437 0.637 . . . . 0.0 110.375 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.692 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -52.78 -41.8 64.44 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.375 -0.828 . . . . 0.0 109.902 -178.07 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.83 -23.22 66.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.031 -1.043 . . . . 0.0 110.719 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.453 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.3 OUTLIER -91.86 -56.3 3.14 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.571 -1.331 . . . . 0.0 111.915 -177.09 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.449 ' C ' ' SG ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -103.7 4.77 35.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.185 -0.947 . . . . 0.0 111.155 -177.425 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.449 ' SG ' ' C ' ' B' ' 604' ' ' PHE . 2.1 m . . . . . 0 N--CA 1.498 1.95 0 O-C-N 120.714 -1.241 . . . . 0.0 109.445 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.838 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.541 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.1 OUTLIER -98.61 126.84 44.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.383 -1.069 . . . . 0.0 109.839 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.5 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.5 OUTLIER -128.58 123.86 34.46 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.296 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.83 137.75 39.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.903 . . . . 0.0 109.561 -179.465 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.23 129.17 34.86 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.06 143.29 37.55 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.882 -1.136 . . . . 0.0 108.353 179.422 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.47 153.24 30.61 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-O 121.65 0.738 . . . . 0.0 109.415 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.464 ' H ' ' HA ' ' A' ' 91' ' ' GLN . 24.5 m80 -123.26 102.16 7.78 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.005 -1.479 . . . . 0.0 107.005 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.96 102.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.503 ' C ' ' H ' ' A' ' 27' ' ' LEU . 53.9 p -75.72 -35.39 60.26 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.34 -0.85 . . . . 0.0 109.675 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -76.01 19.05 0.24 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.181 -0.95 . . . . 0.0 108.496 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.503 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -154.74 -28.51 0.11 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.627 -0.671 . . . . 0.0 109.203 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 24.2 t-20 82.97 12.64 0.46 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 122.135 -0.353 . . . . 0.0 110.199 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -95.27 -178.32 4.41 Favored 'General case' 0 C--N 1.309 -1.181 0 O-C-N 120.85 -1.157 . . . . 0.0 109.881 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.421 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 1.3 m-20 -138.44 121.04 16.22 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.257 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.7 t -119.46 154.58 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.788 0.804 . . . . 0.0 110.577 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -130.8 128.89 41.62 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.811 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 32' ' ' THR . 3.0 mm? -115.1 115.31 26.58 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.39 0.614 . . . . 0.0 110.034 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.541 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.7 tpt180 -59.62 112.29 1.74 Allowed 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -140.73 -171.21 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.983 0.897 . . . . 0.0 110.461 -179.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 p -144.43 176.22 9.54 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.85 44.57 3.14 Favored Glycine 0 N--CA 1.481 1.681 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.502 ' C ' HG21 ' A' ' 78' ' ' THR . 3.4 pt-20 -145.61 1.68 0.92 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.589 -0.948 . . . . 0.0 108.881 178.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.457 ' O ' HG22 ' A' ' 78' ' ' THR . 1.4 m -89.14 134.0 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.939 -1.101 . . . . 0.0 109.547 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.46 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.8 m-70 -73.45 147.37 44.22 Favored 'General case' 0 C--N 1.29 -2.001 0 O-C-N 120.948 -1.095 . . . . 0.0 108.175 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.434 ' C ' ' N ' ' A' ' 43' ' ' GLY . 81.6 mt -48.75 -51.39 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 120.998 -1.064 . . . . 0.0 108.947 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.52 -10.87 6.42 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 108.482 -1.847 . . . . 0.0 108.482 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -74.93 -26.82 65.88 Favored Glycine 0 N--CA 1.483 1.773 0 N-CA-C 107.919 -2.073 . . . . 0.0 107.919 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 45' ' ' MET . 2.1 t -84.13 -42.95 17.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.062 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.404 ' C ' ' O ' ' A' ' 44' ' ' VAL . 40.9 mtm -45.51 -36.25 4.4 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.26 -65.81 0.73 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 121.398 0.618 . . . . 0.0 110.095 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 48.2 mttm -52.88 -55.67 21.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.446 -0.783 . . . . 0.0 111.275 -178.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -45.05 -56.69 4.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.946 -1.097 . . . . 0.0 109.759 -178.524 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.5 t -60.64 -47.36 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.04 -1.037 . . . . 0.0 110.117 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -45.06 -39.63 5.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.153 -0.967 . . . . 0.0 109.85 -179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -65.52 -57.06 9.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.318 -0.864 . . . . 0.0 110.392 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -67.17 0.45 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t0 62.62 89.03 0.09 Allowed 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.863 0.839 . . . . 0.0 109.242 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.704 ' O ' HG22 ' A' ' 54' ' ' VAL . 1.6 p -155.67 33.13 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.303 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 tptt 41.23 17.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.778 -0.576 . . . . 0.0 110.649 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.576 ' N ' ' O ' ' A' ' 54' ' ' VAL . 16.7 ttmm -78.7 146.72 33.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.967 -1.083 . . . . 0.0 109.027 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.53 115.09 2.12 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.509 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 60.4 m95 -117.72 -33.66 4.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.609 -0.682 . . . . 0.0 109.905 -179.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.5 t -42.99 -55.78 3.62 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.433 -0.792 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -50.99 -43.65 60.76 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.211 -0.93 . . . . 0.0 108.521 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -72.45 134.17 45.21 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.732 0.777 . . . . 0.0 110.214 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.86 -179.31 6.51 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.833 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -95.12 137.73 33.77 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.812 -1.18 . . . . 0.0 110.682 -179.384 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.498 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -125.88 148.97 49.03 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.555 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -105.13 92.08 4.07 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.711 -1.243 . . . . 0.0 108.708 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -54.31 -23.57 15.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.255 -0.903 . . . . 0.0 110.734 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.514 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 23.7 mmtp -67.82 -10.56 53.95 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -134.0 -11.43 2.6 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.132 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.555 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.63 45.84 27.86 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -111.93 -171.05 1.77 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.322 0.582 . . . . 0.0 109.804 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.551 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.56 99.68 5.46 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 177.608 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.41 ' HB3' HD13 ' A' ' 41' ' ' ILE . 36.1 mt -60.07 88.47 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.69 1.233 . . . . 0.0 110.634 -176.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.476 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.0 pp -123.04 13.04 9.71 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 178.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' A' ' 76' ' ' HIS . 10.1 mmpt? -75.37 43.18 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.735 -0.603 . . . . 0.0 109.966 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.686 HG21 ' O ' ' B' ' 602' ' ' LYS . 3.7 m -54.75 -6.37 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.982 -1.074 . . . . 0.0 109.58 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.48 ' H ' ' C ' ' A' ' 74' ' ' LYS . 87.2 m-70 -55.97 -68.57 0.19 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.252 -0.905 . . . . 0.0 110.861 -179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -99.05 -115.86 0.15 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.137 -0.977 . . . . 0.0 110.636 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.502 HG21 ' C ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -153.41 155.44 36.37 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.2 pt? -43.8 -51.1 7.58 Favored 'General case' 0 C--N 1.295 -1.78 0 O-C-N 121.275 -0.89 . . . . 0.0 110.654 179.488 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.438 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 17.6 t70 -45.49 -32.25 2.13 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.213 -0.929 . . . . 0.0 109.852 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.554 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -72.55 -32.01 65.72 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 -179.623 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.554 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.5 OUTLIER -73.33 -49.55 26.79 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 124.28 4.55 7.64 Favored Glycine 0 N--CA 1.51 3.619 0 N-CA-C 108.65 -1.78 . . . . 0.0 108.65 179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.9 mt -60.08 162.29 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -156.22 -164.64 1.73 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.048 -1.033 . . . . 0.0 108.741 178.697 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -73.57 -21.27 60.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.175 -0.953 . . . . 0.0 109.833 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.1 3.24 43.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.335 -0.853 . . . . 0.0 109.402 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.98 113.61 25.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.355 -0.841 . . . . 0.0 109.315 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -97.39 125.77 42.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.059 -1.026 . . . . 0.0 109.228 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.6 mt -112.7 178.61 4.23 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.714 0.769 . . . . 0.0 109.388 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.498 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.2 mt-30 -129.9 168.19 17.01 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -123.73 90.88 3.35 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.061 0 O-C-N 121.737 -0.602 . . . . 0.0 110.332 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.543 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.1 m . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.18 137.13 58.24 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.23 -0.919 . . . . 0.0 110.653 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.55 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.86 103.84 13.46 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 178.197 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.5 t -49.62 125.99 12.66 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.086 0.946 . . . . 0.0 109.624 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.33 -34.95 5.2 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 106.444 -2.663 . . . . 0.0 106.444 -177.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.17 -35.29 7.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.01 56.27 6.77 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 122.694 1.235 . . . . 0.0 109.899 -178.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt -140.83 124.7 10.34 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -43.7 138.29 5.8 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 CA-C-N 120.428 1.189 . . . . 0.0 114.83 -178.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.55 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.6 mt -97.61 98.69 7.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 51.8 p -100.06 91.35 4.74 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 121.955 0.883 . . . . 0.0 111.234 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.41 -96.66 0.16 Allowed Glycine 0 N--CA 1.488 2.102 0 N-CA-C 107.349 -2.3 . . . . 0.0 107.349 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.484 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 6.0 mmt-85 -113.08 153.02 28.84 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.027 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.5 p -144.83 126.47 15.13 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.022 -1.049 . . . . 0.0 111.425 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.4 mt -90.61 146.15 6.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 10.9 m -121.5 146.61 46.75 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.0 0.905 . . . . 0.0 109.151 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.738 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -128.92 0.26 Allowed 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.9 mtp -65.75 25.88 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.738 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.0 -8.56 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.84 149.07 28.5 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.5 mmmt -96.02 174.72 6.78 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.43 134.67 7.3 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.436 -1.306 . . . . 0.0 109.939 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.581 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.2 m80 -55.42 114.8 7.87 Favored Pre-proline 0 C--N 1.303 -1.428 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 177.062 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.434 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 47.1 Cg_exo -45.67 -10.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 CA-C-N 120.306 1.145 . . . . 0.0 111.964 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.745 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.9 mt-10 -100.64 -53.01 3.19 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 122.052 0.93 . . . . 0.0 110.067 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.56 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.7 m170 -55.41 -5.92 0.15 Allowed 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.589 -1.319 . . . . 0.0 109.839 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.471 ' H ' ' C ' ' B' ' 571' ' ' GLU . 21.2 t80 -124.27 52.53 1.49 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.745 HG13 ' O ' ' B' ' 571' ' ' GLU . 11.4 m -93.47 176.89 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 CA-C-O 121.514 0.673 . . . . 0.0 110.125 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.549 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.44 144.03 38.12 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 107.597 -1.261 . . . . 0.0 107.597 179.029 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -90.89 74.09 6.49 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 116.258 -2.177 . . . . 0.0 109.488 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -153.99 -65.85 0.14 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 172.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.536 ' O ' ' N ' ' B' ' 580' ' ' LYS . 17.0 p -110.67 84.03 1.86 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 112.514 -2.13 . . . . 0.0 105.616 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 0.857 HD22 ' N ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.49 15.1 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.67 -38.7 15.64 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 119.542 -1.973 . . . . 0.0 112.542 -178.267 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.461 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.4 tp-100 -162.25 142.16 9.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 119.5 -2.0 . . . . 0.0 115.02 178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.549 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.7 tp -136.7 170.1 16.63 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 175.335 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.502 ' O ' ' N ' ' B' ' 587' ' ' PHE . 77.2 m-20 -145.2 129.26 17.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.066 -1.022 . . . . 0.0 109.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -50.84 -22.64 2.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.522 -0.736 . . . . 0.0 109.651 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.12 -18.1 59.89 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.004 -1.638 . . . . 0.0 109.004 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.9 p -133.12 26.31 4.22 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.568 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.3 OUTLIER -89.48 108.53 19.7 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.579 1.18 . . . . 0.0 109.974 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.44 168.4 10.01 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.411 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.46 157.15 40.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.747 -1.221 . . . . 0.0 110.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.456 ' OE1' ' CD2' ' B' ' 600' ' ' PHE . 1.6 tp60 -150.84 144.2 24.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.492 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.5 OUTLIER 41.98 27.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.217 -0.927 . . . . 0.0 110.452 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 3.6 m-20 84.26 -8.37 0.98 Allowed 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.758 -0.588 . . . . 0.0 111.05 179.094 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 53.2 mttt -88.18 116.78 67.26 Favored Pre-proline 0 C--N 1.296 -1.732 0 O-C-N 121.162 -0.961 . . . . 0.0 109.973 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.2 Cg_exo -50.2 163.93 0.54 Allowed 'Trans proline' 0 N--CA 1.492 1.434 0 CA-C-N 119.887 0.995 . . . . 0.0 112.576 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.526 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 21.6 m-85 -170.84 139.65 1.51 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.404 -0.81 . . . . 0.0 109.589 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 10.0 m -68.5 157.23 36.4 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 175.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -60.2 -55.58 32.05 Favored 'General case' 0 C--N 1.294 -1.836 0 C-N-CA 117.253 -1.779 . . . . 0.0 106.56 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.5 -31.28 2.64 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.331 -0.856 . . . . 0.0 109.182 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.28 -56.52 4.15 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.456 ' CD2' ' OE1' ' B' ' 590' ' ' GLN . 2.4 t80 -60.32 -53.53 56.56 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.443 0.64 . . . . 0.0 110.498 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.654 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.45 -43.34 62.06 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.117 -0.989 . . . . 0.0 109.431 -178.348 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.686 ' O ' HG21 ' A' ' 75' ' ' THR . 0.5 OUTLIER -58.82 -20.43 50.36 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.994 -1.066 . . . . 0.0 110.163 -179.208 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.409 ' N ' HD23 ' B' ' 603' ' ' LEU . 1.2 mt -91.98 -56.93 2.89 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.651 -1.28 . . . . 0.0 110.331 -178.65 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' C ' ' B' ' 605' ' ' CYS . 24.5 m-85 -106.41 32.36 4.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.508 -0.745 . . . . 0.0 109.935 -179.085 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' B' ' 604' ' ' PHE . 3.9 t . . . . . 0 N--CA 1.502 2.145 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.759 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.534 ' OG1' ' N ' ' A' ' 18' ' ' TRP . 2.7 t -167.85 178.46 5.2 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 117.548 -1.661 . . . . 0.0 111.693 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.534 ' N ' ' OG1' ' A' ' 17' ' ' THR . 0.5 OUTLIER -165.48 127.87 2.09 Favored 'General case' 0 C--N 1.277 -2.552 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.673 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -83.78 132.21 34.85 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.961 -1.087 . . . . 0.0 109.521 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.488 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.86 133.51 34.73 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.174 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.15 145.73 35.49 Favored 'General case' 0 C--N 1.295 -1.797 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.176 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -137.35 114.11 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.7 0.762 . . . . 0.0 110.015 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -85.76 103.77 14.84 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.526 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.63 107.01 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 27' ' ' LEU . 41.5 p -78.2 -41.08 35.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.327 -0.858 . . . . 0.0 110.037 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -73.02 20.53 0.08 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.055 -1.028 . . . . 0.0 108.793 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.7 mt -154.49 -33.0 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' VAL . 24.7 t-20 85.23 14.09 0.19 Allowed 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 120.707 0.289 . . . . 0.0 110.429 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.0 mtp-105 -95.58 -178.27 4.35 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 120.911 -1.118 . . . . 0.0 110.036 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -135.86 116.98 14.39 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.1 t -115.36 155.13 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.681 0.753 . . . . 0.0 110.004 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.46 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -134.37 131.59 38.45 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' O ' ' A' ' 32' ' ' THR . 2.1 mm? -118.54 115.91 25.57 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.53 ' O ' HG13 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -61.6 133.85 56.13 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.53 HG13 ' O ' ' A' ' 34' ' ' ARG . 13.9 m -160.7 -170.22 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.019 0 CA-C-O 122.071 0.938 . . . . 0.0 110.012 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.417 ' C ' ' H ' ' A' ' 38' ' ' GLU . 0.8 OUTLIER -142.13 171.16 14.43 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.047 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -77.58 45.04 2.33 Favored Glycine 0 C--N 1.293 -1.831 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.435 ' C ' HG21 ' A' ' 78' ' ' THR . 0.7 OUTLIER -144.99 3.49 1.06 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.765 -0.844 . . . . 0.0 108.926 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.577 ' O ' HG22 ' A' ' 78' ' ' THR . 2.6 m -90.1 135.69 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.041 -1.037 . . . . 0.0 110.076 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.445 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.8 OUTLIER -72.5 142.46 48.54 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 120.944 -1.098 . . . . 0.0 108.217 178.932 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.466 ' C ' ' N ' ' A' ' 43' ' ' GLY . 94.1 mt -47.8 -55.54 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.051 -1.031 . . . . 0.0 109.268 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.512 ' H ' HG23 ' A' ' 75' ' ' THR . . . -55.8 -8.9 2.32 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.531 -1.828 . . . . 0.0 108.531 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -75.12 -28.25 62.62 Favored Glycine 0 N--CA 1.484 1.869 0 N-CA-C 107.585 -2.206 . . . . 0.0 107.585 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.29 -40.88 16.53 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.475 ' O ' HG23 ' A' ' 49' ' ' VAL . 42.1 mtm -47.64 -35.02 8.73 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.57 -65.72 0.79 Allowed 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.745 -0.597 . . . . 0.0 109.954 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 53.5 mttm -49.39 -59.85 3.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.372 -0.83 . . . . 0.0 110.8 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.51 -55.56 6.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.016 -1.052 . . . . 0.0 109.39 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 45' ' ' MET . 70.0 t -56.5 -48.76 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -46.72 -40.71 13.87 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.053 -1.03 . . . . 0.0 109.591 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -76.6 -36.83 57.26 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.411 -0.805 . . . . 0.0 110.853 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.484 HD12 ' CG1' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -59.74 -65.01 0.75 Allowed 'General case' 0 C--N 1.305 -1.342 0 O-C-N 120.914 -1.116 . . . . 0.0 108.904 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 67.16 79.25 0.23 Allowed 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 121.822 0.82 . . . . 0.0 109.816 179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.562 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.7 p -171.03 146.06 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 C-N-CA 119.696 -0.802 . . . . 0.0 110.005 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.28 34.91 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.315 -0.866 . . . . 0.0 108.931 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.562 ' H ' ' C ' ' A' ' 54' ' ' VAL . 16.0 ttmm -77.74 161.49 27.67 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.127 -0.983 . . . . 0.0 108.873 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -77.13 90.64 3.66 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 109.027 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.464 ' O ' ' O ' ' A' ' 61' ' ' HIS . 11.1 m0 -72.8 -58.15 3.56 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.344 -0.848 . . . . 0.0 109.106 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.5 t -42.25 -56.87 2.76 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.288 0.565 . . . . 0.0 110.463 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -53.87 -45.99 71.16 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 58' ' ' TRP . 51.6 m170 -72.94 121.03 19.4 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.794 0.807 . . . . 0.0 110.127 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -134.45 177.96 7.36 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.843 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.45 140.47 29.78 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.894 -1.129 . . . . 0.0 109.705 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.488 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.49 151.37 48.93 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.35 94.08 4.84 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.064 -1.022 . . . . 0.0 108.659 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.431 ' OE2' ' OE1' ' A' ' 91' ' ' GLN . 10.6 pt-20 -55.4 -23.42 24.61 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.327 -0.858 . . . . 0.0 110.886 -179.147 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.534 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.9 mmtp -69.34 -9.32 52.83 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -133.63 -11.81 2.7 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.068 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.6 45.54 28.43 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.076 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -112.36 -172.32 2.02 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.441 0.639 . . . . 0.0 109.798 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.535 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.79 99.65 5.63 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 177.391 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.1 mt -59.88 84.93 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.667 1.222 . . . . 0.0 110.73 -176.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -121.92 10.39 10.17 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -84.66 33.47 0.52 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.512 HG23 ' H ' ' A' ' 42' ' ' GLY . 24.0 m -49.63 -10.01 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 0.0 109.579 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' LYS . 12.8 m80 -55.61 -15.05 2.5 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.187 -0.945 . . . . 0.0 109.89 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -138.07 -122.25 0.13 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.227 -0.921 . . . . 0.0 109.413 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.577 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -151.96 -164.53 2.0 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.15 -1.594 . . . . 0.0 111.11 -178.374 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.566 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.3 mp -71.53 -56.0 6.75 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -43.15 -48.52 6.38 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.667 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.501 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -57.15 -30.41 64.42 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.931 -178.59 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.501 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -88.76 -44.7 10.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.135 -0.978 . . . . 0.0 108.575 179.712 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 111.23 27.24 4.29 Favored Glycine 0 N--CA 1.501 3.005 0 N-CA-C 108.515 -1.834 . . . . 0.0 108.515 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.456 HG22 ' N ' ' A' ' 85' ' ' GLN . 38.8 mt -82.61 160.96 3.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.788 -0.83 . . . . 0.0 109.614 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.456 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.4 tp60 -166.65 -173.3 2.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.439 -0.788 . . . . 0.0 108.894 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.48 -22.65 67.03 Favored 'General case' 0 C--N 1.298 -1.673 0 O-C-N 121.466 -0.771 . . . . 0.0 110.137 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.26 -8.84 59.35 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.098 -179.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.488 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.04 113.73 26.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.562 -0.711 . . . . 0.0 109.099 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -94.43 117.33 29.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.974 -1.079 . . . . 0.0 109.527 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.435 ' HG ' HD12 ' A' ' 20' ' ' LEU . 8.9 mt -95.7 176.89 5.98 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.484 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.9 mt-30 -131.88 168.13 18.39 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -122.38 91.9 3.6 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.501 2.091 0 O-C-N 121.65 -0.656 . . . . 0.0 109.834 -177.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -57.28 135.18 56.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.742 -1.224 . . . . 0.0 110.523 -178.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.549 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.97 103.99 13.67 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.372 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.0 t -49.46 125.86 12.09 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 122.045 0.926 . . . . 0.0 109.786 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.27 -34.77 5.31 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 106.406 -2.678 . . . . 0.0 106.406 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -105.12 -35.75 7.51 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.21 56.45 6.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.736 1.255 . . . . 0.0 109.826 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -140.63 123.89 10.14 Favored Pre-proline 0 C--N 1.294 -1.826 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 177.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -43.84 134.42 7.84 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 CA-C-N 120.429 1.189 . . . . 0.0 114.825 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.549 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.5 mt -93.02 99.99 10.58 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 67.1 p -101.45 93.14 5.24 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.241 -0.912 . . . . 0.0 111.22 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.5 -94.35 0.14 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.323 -2.311 . . . . 0.0 107.323 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.471 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -115.88 152.47 33.33 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.78 126.9 15.61 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.981 -1.074 . . . . 0.0 111.5 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 561' ' ' ILE . . . . . 0.488 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 49.6 mt -91.02 146.27 6.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.688 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 9.3 m -121.03 146.25 46.91 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.939 0.876 . . . . 0.0 109.091 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.735 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.83 -128.87 0.26 Allowed 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 5.9 mtp -65.89 26.09 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.569 -0.707 . . . . 0.0 109.11 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.735 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.28 -8.97 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 148.53 27.89 Favored 'General case' 0 C--N 1.306 -1.298 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -94.65 174.8 6.93 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.64 134.96 7.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.442 -1.303 . . . . 0.0 109.929 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.4 m80 -55.91 115.33 9.36 Favored Pre-proline 0 C--N 1.302 -1.473 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.437 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 44.3 Cg_exo -45.75 -11.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.317 1.149 . . . . 0.0 111.586 -178.526 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.74 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.2 mt-10 -98.3 -52.87 3.52 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 122.102 0.953 . . . . 0.0 110.077 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.532 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.1 m170 -57.04 -4.58 0.19 Allowed 'General case' 0 C--N 1.292 -1.901 0 O-C-N 120.633 -1.292 . . . . 0.0 109.715 -179.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' B' ' 571' ' ' GLU . 14.0 t80 -127.55 54.43 1.68 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.279 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.74 HG13 ' O ' ' B' ' 571' ' ' GLU . 13.8 m -93.53 177.58 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 121.624 0.726 . . . . 0.0 110.147 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.659 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.88 141.42 32.24 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.369 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 576' ' ' ALA . . . . . 0.488 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.52 76.41 6.6 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 116.719 -1.992 . . . . 0.0 108.801 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -153.1 -61.52 0.15 Allowed 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 102.498 -3.149 . . . . 0.0 102.498 174.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 20.8 p -120.16 81.57 1.76 Allowed 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 111.647 -2.524 . . . . 0.0 104.803 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.2 mt -53.02 15.48 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.53 -38.15 17.5 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 119.636 -1.915 . . . . 0.0 112.258 -178.547 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.441 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.4 tp-100 -161.09 142.36 11.69 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 119.673 -1.892 . . . . 0.0 114.341 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.659 HD13 ' HB2' ' B' ' 575' ' ' CYS . 24.0 tp -134.06 171.02 14.79 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 74.0 m-20 -146.77 128.53 15.27 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.186 -0.947 . . . . 0.0 109.468 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.688 ' CE ' ' H ' ' B' ' 562' ' ' THR . 4.5 ptpp? -50.66 -19.41 0.92 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.622 -0.673 . . . . 0.0 110.014 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -85.51 -21.15 55.01 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.894 -1.683 . . . . 0.0 108.894 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -133.75 28.63 3.9 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.69 107.05 18.87 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 122.788 1.28 . . . . 0.0 110.288 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.516 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -100.88 168.46 9.62 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 12.0 tt0 -152.4 157.22 40.93 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.795 -1.191 . . . . 0.0 110.673 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.598 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 1.2 tp-100 -154.15 145.83 23.31 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.493 HD21 ' HG3' ' B' ' 593' ' ' LYS . 0.2 OUTLIER 45.68 23.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.03 -1.044 . . . . 0.0 109.872 -179.719 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.77 -4.85 1.54 Allowed 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.386 0.612 . . . . 0.0 110.482 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 593' ' ' LYS . . . . . 0.493 ' HG3' HD21 ' B' ' 591' ' ' ASN . 37.2 mttm -88.59 121.19 70.24 Favored Pre-proline 0 C--N 1.294 -1.825 0 O-C-N 121.306 -0.871 . . . . 0.0 109.394 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.44 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 49.7 Cg_exo -48.84 164.64 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.22 0 CA-C-N 120.106 1.073 . . . . 0.0 111.782 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' B' ' 588' ' ' LYS . 7.4 m-85 -170.75 142.08 1.91 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.024 -1.048 . . . . 0.0 110.373 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 596' ' ' CYS . . . . . 0.43 ' HG ' ' CB ' ' B' ' 575' ' ' CYS . 22.4 m -77.8 154.78 31.57 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -60.58 -58.3 9.07 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -46.17 -26.64 0.81 Allowed 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.675 -0.64 . . . . 0.0 109.484 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.4 m -85.0 -63.9 1.25 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.544 -0.722 . . . . 0.0 109.099 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -52.49 -53.85 40.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.519 -0.738 . . . . 0.0 109.355 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.635 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -49.59 -42.33 44.33 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.52 -24.73 14.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.364 -0.835 . . . . 0.0 109.559 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.8 mt -93.76 -57.21 2.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.251 -0.906 . . . . 0.0 111.685 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.598 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.6 m-85 -87.16 31.5 0.72 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.046 -1.034 . . . . 0.0 110.253 -178.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.943 -1.098 . . . . 0.0 109.447 179.253 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.429 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.557 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -84.61 125.55 32.55 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.118 -1.225 . . . . 0.0 109.44 179.789 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.87 118.96 23.58 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.61 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.06 127.44 32.91 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.068 -1.053 . . . . 0.0 108.368 -179.769 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.493 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -82.82 134.02 35.12 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 179.568 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -76.78 145.66 38.38 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.414 ' N ' ' O ' ' A' ' 31' ' ' VAL . 14.3 t -137.57 105.85 3.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 CA-C-O 121.784 0.802 . . . . 0.0 110.036 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.499 ' NE2' ' OD1' ' A' ' 30' ' ' ASP . 23.7 m80 -82.5 103.53 12.11 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -73.72 120.18 22.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.498 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 p -80.35 -60.51 2.29 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.06 -1.025 . . . . 0.0 111.064 -177.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.435 ' N ' ' OG1' ' A' ' 25' ' ' THR . 14.0 t0 -50.04 -11.01 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.755 -1.215 . . . . 0.0 109.853 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 25' ' ' THR . 2.6 mt -119.13 -37.17 3.24 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' VAL . 21.8 t-20 85.93 8.15 0.33 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 122.364 -0.21 . . . . 0.0 111.555 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.642 ' NH1' HD22 ' A' ' 52' ' ' LEU . 27.5 ptt180 -93.28 -175.75 3.92 Favored 'General case' 0 C--N 1.31 -1.112 0 O-C-N 120.487 -1.383 . . . . 0.0 109.236 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' NE2' ' A' ' 23' ' ' HIS . 20.6 m-20 -131.97 115.81 16.33 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.705 0.764 . . . . 0.0 109.125 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.422 HG12 ' N ' ' A' ' 32' ' ' THR . 35.7 t -109.21 157.2 9.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.426 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.5 131.84 40.31 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 179.411 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.426 HD22 ' C ' ' A' ' 32' ' ' THR . 2.1 mm? -113.8 113.08 24.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.617 -0.677 . . . . 0.0 109.291 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.557 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 10.7 tpt180 -60.03 104.17 0.28 Allowed 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.28 -169.54 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 122.119 0.961 . . . . 0.0 110.89 -178.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.414 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.4 p -144.93 172.42 13.06 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.16 43.48 2.25 Favored Glycine 0 N--CA 1.483 1.804 0 N-CA-C 108.921 -1.672 . . . . 0.0 108.921 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.48 ' C ' HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -142.39 3.61 1.53 Allowed 'General case' 0 N--CA 1.486 1.327 0 O-C-N 121.608 -0.936 . . . . 0.0 108.785 179.815 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -90.45 133.4 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.142 -0.974 . . . . 0.0 110.142 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.4 m-70 -76.24 144.2 40.51 Favored 'General case' 0 C--N 1.293 -1.867 0 O-C-N 120.814 -1.179 . . . . 0.0 108.579 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.457 ' C ' ' N ' ' A' ' 43' ' ' GLY . 82.5 mt -49.08 -51.53 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.992 -1.068 . . . . 0.0 109.101 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.55 -15.99 4.84 Favored Glycine 0 N--CA 1.484 1.847 0 N-CA-C 108.283 -1.927 . . . . 0.0 108.283 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.457 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -85.43 -25.85 38.06 Favored Glycine 0 N--CA 1.485 1.935 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 41' ' ' ILE . 38.5 t -81.44 -50.1 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.527 -0.984 . . . . 0.0 109.35 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.418 ' HB2' ' NE2' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -55.67 -41.0 73.04 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.806 -1.184 . . . . 0.0 108.419 179.406 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.59 HD12 HD13 ' B' ' 603' ' ' LEU . 5.8 tt -50.24 -58.56 5.34 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.239 -0.913 . . . . 0.0 109.174 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 48' ' ' LEU . 61.8 mttm -52.13 -54.54 29.36 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.468 -0.77 . . . . 0.0 110.561 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 48' ' ' LEU . 4.0 mm? -45.67 -61.89 1.52 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.547 -1.346 . . . . 0.0 108.822 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 53' ' ' ASP . 97.4 t -52.69 -49.87 44.03 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 O-C-N 121.526 -0.733 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -46.3 -40.61 11.97 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.714 -1.241 . . . . 0.0 109.711 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.425 ' NZ ' HD11 ' A' ' 33' ' ' LEU . 54.5 mttp -69.3 -57.63 5.06 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.322 -0.861 . . . . 0.0 110.325 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.642 HD22 ' NH1' ' A' ' 29' ' ' ARG . 16.2 tp -110.34 41.98 1.65 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.475 1.131 . . . . 0.0 109.56 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.626 ' N ' ' O ' ' A' ' 49' ' ' VAL . 36.4 t0 -52.08 -84.92 0.01 OUTLIER 'General case' 0 C--N 1.263 -3.186 0 CA-C-O 122.232 1.015 . . . . 0.0 109.291 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 55' ' ' LYS . 14.1 p 43.14 179.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.277 -2.569 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.861 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.737 ' H ' HG22 ' A' ' 54' ' ' VAL . 0.7 OUTLIER -77.33 30.49 0.15 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.643 -1.286 . . . . 0.0 108.208 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.621 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 36.7 tttm -79.57 137.42 37.15 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.081 -1.048 . . . . 0.0 109.033 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -50.95 112.44 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.567 -0.708 . . . . 0.0 110.126 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.621 ' CH2' ' NZ ' ' A' ' 56' ' ' LYS . 12.7 m95 -127.44 -21.34 3.85 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.708 0.766 . . . . 0.0 109.788 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.2 t -40.05 -52.79 2.48 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.2 -0.938 . . . . 0.0 111.369 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.421 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 17.2 t0 -83.62 13.37 4.68 Favored 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.537 -0.727 . . . . 0.0 110.963 -178.182 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.62 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 3.6 p-80 -71.59 148.75 46.3 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 120.741 -1.224 . . . . 0.0 111.988 -178.496 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.98 155.22 5.5 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -93.93 148.46 22.13 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.532 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.25 151.52 48.61 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.333 -0.854 . . . . 0.0 108.913 -178.982 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -112.65 94.65 5.01 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.903 . . . . 0.0 108.639 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -55.77 -23.9 32.36 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.245 -0.909 . . . . 0.0 110.872 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.529 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -68.8 -9.03 48.69 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 178.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.56 -12.22 2.7 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.842 -178.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.1 mpp_? 52.43 45.77 27.91 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -113.37 -173.35 2.24 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.673 0.749 . . . . 0.0 110.143 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.32 101.64 7.06 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.721 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' LEU . 34.4 mt -61.74 86.06 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.292 0 O-C-N 120.433 -1.417 . . . . 0.0 110.892 -176.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 8.74 11.39 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.529 ' C ' ' H ' ' A' ' 76' ' ' HIS . 9.5 mmpt? -74.93 58.53 0.85 Allowed 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.1 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.587 HG21 ' O ' ' B' ' 602' ' ' LYS . 0.9 OUTLIER -58.82 -5.95 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.694 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -36.03 -63.44 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.883 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.417 ' HB3' ' H ' ' A' ' 78' ' ' THR . 1.2 t90 -130.78 -100.04 0.31 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.222 -0.924 . . . . 0.0 111.221 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -151.35 -164.38 1.98 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 119.671 -1.893 . . . . 0.0 111.365 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.595 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -68.8 -57.79 5.09 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -42.35 -46.7 4.7 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.499 ' HD2' ' H ' ' A' ' 78' ' ' THR . 0.0 OUTLIER -62.23 -28.93 70.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.909 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.487 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -85.79 -47.4 9.76 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.418 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 113.59 21.71 5.68 Favored Glycine 0 N--CA 1.499 2.854 0 N-CA-C 108.088 -2.005 . . . . 0.0 108.088 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.505 HG22 ' N ' ' A' ' 85' ' ' GLN . 36.4 mt -82.53 161.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.877 -0.778 . . . . 0.0 109.907 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.505 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.7 tp60 -167.76 -163.4 0.49 Allowed 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.37 -27.12 62.18 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.435 -0.791 . . . . 0.0 109.598 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.71 -14.46 62.46 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.463 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.32 113.93 26.51 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -94.67 118.85 32.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.015 -1.053 . . . . 0.0 109.577 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.493 ' HG ' HD12 ' A' ' 20' ' ' LEU . 9.4 mt -96.0 176.94 5.92 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.714 0.768 . . . . 0.0 109.675 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.532 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 10.0 mt-30 -131.13 165.56 23.02 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 58' ' ' TRP . 31.8 t80 -133.8 90.92 2.76 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.987 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.663 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.552 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m . . . . . 0 N--CA 1.488 1.474 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.84 135.21 57.71 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 120.774 -1.204 . . . . 0.0 110.39 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.484 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.72 103.82 13.32 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 178.247 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -50.8 127.05 17.42 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-O 122.14 0.972 . . . . 0.0 109.601 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.68 -34.56 5.4 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 106.043 -2.823 . . . . 0.0 106.043 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -106.04 -35.71 7.17 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.03 56.31 6.73 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 122.663 1.22 . . . . 0.0 109.968 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -140.72 124.17 10.18 Favored Pre-proline 0 C--N 1.293 -1.855 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.4 135.14 9.14 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.452 1.197 . . . . 0.0 114.583 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.552 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.8 mt -93.64 98.49 8.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 557' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.4 p -99.52 91.36 4.87 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.29 -0.881 . . . . 0.0 111.313 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.63 -95.31 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.455 -2.258 . . . . 0.0 107.455 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.478 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.28 151.66 32.55 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.56 126.3 15.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.964 -1.085 . . . . 0.0 111.556 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 561' ' ' ILE . . . . . 0.477 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 46.8 mt -91.29 146.86 5.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.735 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.3 m -117.41 147.06 43.02 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-O 121.888 0.851 . . . . 0.0 109.336 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.29 -129.17 0.26 Allowed 'General case' 0 C--N 1.295 -1.789 0 CA-C-O 121.499 0.666 . . . . 0.0 109.383 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.73 26.13 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.19 -9.03 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.89 163.56 22.17 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -106.1 174.25 5.97 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.14 138.11 9.96 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.33 -1.348 . . . . 0.0 109.813 -179.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.596 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.4 m80 -57.16 116.24 12.98 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 177.1 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.44 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 52.7 Cg_exo -45.13 -10.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.461 0 CA-C-N 120.311 1.147 . . . . 0.0 111.894 -178.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.922 ' O ' HG13 ' B' ' 574' ' ' VAL . 12.4 mt-10 -100.06 -52.42 3.42 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.018 0.913 . . . . 0.0 110.042 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.486 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.5 m170 -58.01 -4.25 0.31 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.864 -1.147 . . . . 0.0 109.81 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.1 t80 -125.91 54.66 1.5 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.922 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.4 m -93.9 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 CA-C-O 121.925 0.869 . . . . 0.0 110.616 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.634 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.29 143.6 31.19 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.626 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.47 74.76 3.29 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 116.672 -2.011 . . . . 0.0 109.84 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 577' ' ' PHE . . . . . 0.568 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 0.3 OUTLIER -153.65 -48.31 0.09 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 102.047 -3.316 . . . . 0.0 102.047 173.244 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.544 ' SG ' ' O ' ' B' ' 578' ' ' CYS . 29.5 p -132.0 81.52 1.97 Allowed 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 176.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.8 mt -53.1 15.65 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.47 -37.38 18.34 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 119.686 -1.884 . . . . 0.0 112.628 -178.255 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.415 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -160.3 140.72 11.69 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 119.596 -1.94 . . . . 0.0 114.448 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.634 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.6 tp -137.77 169.82 17.13 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.5 m-20 -146.22 133.58 20.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.27 -0.894 . . . . 0.0 109.429 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.735 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 2.7 ptpp? -55.38 -14.4 1.89 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.703 0.763 . . . . 0.0 109.518 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -92.9 -16.08 49.61 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -137.31 28.58 2.77 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 3.7 p90 -89.17 111.71 22.55 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 122.304 1.05 . . . . 0.0 109.814 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.56 167.12 10.0 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.873 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.439 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.6 tt0 -152.84 157.56 40.9 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.665 -1.272 . . . . 0.0 110.855 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.439 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 1.3 tp-100 -159.25 146.53 17.18 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 106.214 -1.773 . . . . 0.0 106.214 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.472 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.0 OUTLIER 48.1 22.62 0.43 Allowed 'General case' 0 C--N 1.296 -1.726 0 O-C-N 120.954 -1.091 . . . . 0.0 109.505 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.472 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 80.72 -5.75 1.7 Allowed 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.718 -0.614 . . . . 0.0 110.849 178.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 593' ' ' LYS . . . . . 0.475 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 31.8 mttm -90.5 116.86 67.34 Favored Pre-proline 0 C--N 1.294 -1.824 0 O-C-N 121.22 -0.925 . . . . 0.0 109.483 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.527 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 36.0 Cg_exo -49.52 165.9 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.303 0 CA-C-N 120.026 1.045 . . . . 0.0 112.13 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 42.2 m-85 -170.13 138.68 1.7 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.24 -0.912 . . . . 0.0 109.776 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.3 m -69.57 152.84 44.3 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.343 -2.466 . . . . 0.0 104.343 174.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -57.0 -56.9 15.78 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -45.85 -30.61 1.76 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.462 -0.773 . . . . 0.0 109.731 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 599' ' ' CYS . . . . . 0.568 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 81.0 m -81.23 -60.96 2.09 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.262 -0.898 . . . . 0.0 108.806 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.583 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -57.42 -53.63 55.96 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.124 0.488 . . . . 0.0 110.187 -179.595 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.71 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -49.83 -43.47 48.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.981 -1.074 . . . . 0.0 109.108 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.587 ' O ' HG21 ' A' ' 75' ' ' THR . 60.0 tttt -55.77 -21.06 17.15 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.104 -0.997 . . . . 0.0 109.46 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.59 HD13 HD12 ' A' ' 46' ' ' LEU . 4.8 mt -91.92 -56.75 2.97 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.28 -0.887 . . . . 0.0 110.194 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -98.85 30.25 3.43 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.192 -0.943 . . . . 0.0 109.438 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.493 1.69 0 O-C-N 120.836 -1.165 . . . . 0.0 109.224 179.603 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.551 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.497 2.715 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.684 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 39.3 p -79.93 130.02 34.96 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.318 -1.107 . . . . 0.0 109.511 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.551 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -148.81 126.09 11.5 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.857 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -81.27 130.21 34.93 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.979 -1.076 . . . . 0.0 109.895 -179.68 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.73 HD11 ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.47 133.03 34.49 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.343 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.46 142.67 39.04 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.017 -1.052 . . . . 0.0 108.595 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 90' ' ' LEU . 24.8 t -136.25 109.93 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 CA-C-O 121.965 0.888 . . . . 0.0 109.992 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 3.6 m80 -85.72 103.84 14.88 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.8 t -72.53 109.95 5.2 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.643 -1.223 . . . . 0.0 107.796 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.462 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -80.38 -39.29 28.69 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.166 -0.959 . . . . 0.0 109.588 -178.86 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 8.7 t0 -67.65 3.15 1.5 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.0 108.89 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.472 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.3 mt -139.63 -28.6 0.76 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.492 -0.755 . . . . 0.0 109.093 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 24.5 t-20 82.55 12.88 0.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 122.124 -0.36 . . . . 0.0 110.432 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.4 mtp-105 -94.87 -178.27 4.45 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.854 -1.154 . . . . 0.0 109.72 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 40.7 m-20 -138.38 115.98 11.35 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.415 HG12 ' N ' ' A' ' 32' ' ' THR . 18.5 t -117.16 157.69 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 CA-C-O 121.666 0.746 . . . . 0.0 110.145 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.451 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.18 130.32 38.99 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.59 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.451 HD22 ' O ' ' A' ' 32' ' ' THR . 2.9 mm? -116.73 115.88 26.47 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.17 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.684 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -61.37 138.48 58.25 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 34' ' ' ARG . 11.5 m -160.33 -169.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.438 0 CA-C-O 121.788 0.804 . . . . 0.0 109.241 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.475 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.7 p -145.18 165.13 29.23 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 178.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -74.16 43.93 1.3 Allowed Glycine 0 C--N 1.292 -1.887 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.499 ' HA ' HG21 ' A' ' 78' ' ' THR . 0.8 OUTLIER -144.27 3.99 1.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.684 -0.892 . . . . 0.0 108.943 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.674 ' O ' HG22 ' A' ' 78' ' ' THR . 3.0 m -90.12 149.51 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.116 -0.99 . . . . 0.0 110.05 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -85.31 142.48 29.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.829 -1.17 . . . . 0.0 108.045 178.791 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 94.3 mt -47.77 -54.9 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.081 -1.012 . . . . 0.0 109.041 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.541 ' H ' HG23 ' A' ' 75' ' ' THR . . . -55.2 -17.04 10.03 Favored Glycine 0 N--CA 1.484 1.882 0 N-CA-C 108.224 -1.95 . . . . 0.0 108.224 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -70.84 -29.31 69.45 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.319 -1.912 . . . . 0.0 108.319 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.26 -36.36 12.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.1 mtm -51.29 -37.02 45.21 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.7 tp -69.89 -65.95 0.65 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.461 0.648 . . . . 0.0 110.66 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.9 mtmm -53.81 -55.7 24.17 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.41 -0.806 . . . . 0.0 111.467 -178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.412 HD21 ' CD1' ' A' ' 92' ' ' PHE . 62.2 tp -45.98 -48.67 16.5 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.875 -1.14 . . . . 0.0 109.958 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.9 t -67.8 -46.1 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.972 -1.08 . . . . 0.0 109.633 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -45.28 -38.43 5.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.284 -0.885 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -66.59 -44.69 81.48 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.369 -0.832 . . . . 0.0 109.992 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -60.13 -65.18 0.72 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.011 -1.056 . . . . 0.0 108.361 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.5 t70 76.44 80.83 0.09 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.964 0.887 . . . . 0.0 110.561 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.494 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.32 140.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.633 ' HZ2' HD12 ' B' ' 579' ' ' LEU . 1.8 tptp -69.18 35.67 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.376 -0.827 . . . . 0.0 109.946 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 54' ' ' VAL . 11.6 ttmm -78.44 147.12 34.12 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.989 -1.07 . . . . 0.0 109.024 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.425 ' OD2' ' N ' ' A' ' 57' ' ' ASP . 0.9 OUTLIER -61.86 107.03 0.77 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.537 -0.727 . . . . 0.0 109.377 179.805 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.511 ' O ' ' N ' ' A' ' 61' ' ' HIS . 75.8 m95 -106.42 -35.12 7.2 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.373 -0.83 . . . . 0.0 110.224 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.405 ' C ' ' O ' ' A' ' 58' ' ' TRP . 1.5 t -41.57 -51.21 3.99 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.457 -0.777 . . . . 0.0 109.826 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -56.6 -37.73 71.06 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.511 ' N ' ' O ' ' A' ' 58' ' ' TRP . 8.5 m80 -72.64 134.79 45.28 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-O 121.649 0.738 . . . . 0.0 109.849 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -145.95 174.83 10.92 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.766 HD22 ' N ' ' A' ' 63' ' ' LEU . 2.1 mm? -94.54 141.02 29.08 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.885 -1.134 . . . . 0.0 109.978 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.497 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -125.32 151.12 46.46 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.674 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.541 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.03 93.64 4.58 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.041 -1.037 . . . . 0.0 108.652 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.72 -24.21 21.11 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.179 -0.951 . . . . 0.0 111.043 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.533 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -67.97 -9.44 45.43 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -133.78 -12.53 2.61 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.955 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 52.49 45.74 28.0 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.038 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.0 t -112.13 -171.49 1.86 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.393 0.616 . . . . 0.0 109.697 -178.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.544 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.89 99.14 5.4 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 177.147 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -60.3 83.94 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 122.594 1.188 . . . . 0.0 110.608 -176.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.4 pp -118.97 6.97 11.36 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 178.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.508 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -83.63 57.31 4.01 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.594 HG21 ' O ' ' B' ' 602' ' ' LYS . 5.4 m -49.71 -11.65 0.06 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.056 -1.028 . . . . 0.0 109.126 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.508 ' N ' ' O ' ' A' ' 74' ' ' LYS . 41.1 m80 -64.45 150.06 47.28 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.404 -0.81 . . . . 0.0 109.786 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 78.8 m95 54.98 -129.26 2.16 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.756 -0.59 . . . . 0.0 110.319 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.674 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -156.24 -163.66 1.51 Allowed 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 118.262 -1.375 . . . . 0.0 112.886 -177.935 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.595 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.3 mp -69.03 -56.06 8.92 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -44.82 -46.29 10.6 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.731 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -58.3 -31.24 67.31 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.768 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.519 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -85.11 -46.23 11.32 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.861 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.13 14.32 7.19 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 108.631 -1.787 . . . . 0.0 108.631 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.523 HG22 ' N ' ' A' ' 85' ' ' GLN . 35.8 mt -72.61 161.53 4.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.726 -0.867 . . . . 0.0 109.902 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.523 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.4 tp60 -170.38 -171.97 1.18 Allowed 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.45 -20.02 65.44 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 109.993 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.506 ' OD2' ' N ' ' A' ' 88' ' ' ALA . 46.0 p-10 -79.92 -21.0 44.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.73 ' O ' HD11 ' A' ' 20' ' ' LEU . . . -103.47 112.39 25.27 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.893 ' O ' HD23 ' A' ' 90' ' ' LEU . 4.6 ptpp? -98.41 174.5 6.44 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.035 -1.04 . . . . 0.0 110.317 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.893 HD23 ' O ' ' A' ' 89' ' ' LYS . 2.3 mt -138.13 179.69 6.3 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.913 0.863 . . . . 0.0 109.368 -178.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.482 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.3 mt-30 -129.81 168.55 16.39 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.412 ' CD1' HD21 ' A' ' 48' ' ' LEU . 14.6 t80 -131.39 99.5 4.85 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.729 -176.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.535 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.4 m . . . . . 0 N--CA 1.487 1.408 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.8 mp -56.35 134.97 53.97 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 120.818 -1.176 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.554 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.61 104.26 14.44 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.3 t -49.38 126.08 12.41 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 122.139 0.971 . . . . 0.0 109.89 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.18 -35.95 4.63 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 106.381 -2.688 . . . . 0.0 106.381 -177.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.8 m -103.53 -35.99 8.12 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 55.25 56.07 6.83 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.819 1.295 . . . . 0.0 109.861 -178.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -140.94 124.1 9.93 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -43.57 134.73 7.07 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 CA-C-N 120.461 1.2 . . . . 0.0 114.956 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.554 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.2 mt -92.88 98.3 8.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -98.48 92.54 5.7 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.196 -0.94 . . . . 0.0 111.398 -177.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.56 -96.26 0.16 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 107.421 -2.271 . . . . 0.0 107.421 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.467 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 7.2 mmt180 -114.88 153.09 31.12 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 177.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -144.49 126.79 15.77 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.923 -1.111 . . . . 0.0 111.373 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.3 mt -90.38 146.05 6.67 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.41 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 10.1 m -121.71 146.28 47.18 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 122.008 0.908 . . . . 0.0 109.018 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.712 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.27 -128.73 0.27 Allowed 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.546 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.6 mtt -66.0 26.19 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.531 -0.731 . . . . 0.0 109.081 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.712 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.08 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.46 147.78 28.53 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -94.46 174.59 7.05 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.212 -0.93 . . . . 0.0 108.556 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.9 136.49 7.99 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.767 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.579 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -56.84 116.29 12.78 Favored Pre-proline 0 C--N 1.3 -1.575 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.436 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 39.1 Cg_exo -46.67 -10.2 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.471 0 CA-C-N 120.359 1.164 . . . . 0.0 111.399 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.918 ' O ' HG13 ' B' ' 574' ' ' VAL . 14.0 mt-10 -98.07 -52.08 3.82 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 122.019 0.914 . . . . 0.0 110.066 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.497 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 20.4 m170 -58.64 -4.17 0.39 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 120.949 -1.094 . . . . 0.0 109.764 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.437 ' H ' ' C ' ' B' ' 571' ' ' GLU . 17.0 t80 -128.09 58.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.918 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.31 177.45 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.709 0.766 . . . . 0.0 111.359 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.589 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.48 147.36 35.92 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.84 74.35 3.58 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 116.595 -2.042 . . . . 0.0 110.033 179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -154.14 -65.61 0.14 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 102.436 -3.172 . . . . 0.0 102.436 172.258 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -111.04 82.06 1.53 Allowed 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.296 -2.229 . . . . 0.0 105.238 177.175 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 0.846 HD22 ' N ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.0 15.4 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -176.677 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.5 -36.66 16.3 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 119.595 -1.941 . . . . 0.0 113.016 -178.275 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -159.76 139.8 11.7 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 119.359 -2.088 . . . . 0.0 115.179 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.1 tp -139.53 168.7 19.22 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.2 m-20 -150.2 133.53 16.41 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.156 -0.965 . . . . 0.0 109.264 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.41 ' HE3' ' H ' ' B' ' 562' ' ' THR . 9.0 ptpt -51.3 -18.11 0.89 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.482 -0.761 . . . . 0.0 109.432 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -19.32 53.11 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 -179.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 586' ' ' THR . . . . . 0.404 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.7 p -134.31 25.58 3.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.559 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.6 109.87 21.02 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.339 1.066 . . . . 0.0 109.897 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.18 159.28 15.68 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 179.647 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.6 tt0 -154.39 156.94 37.77 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.624 1.202 . . . . 0.0 111.147 -178.379 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.435 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 19.1 pt20 -157.25 145.79 19.57 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.532 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.47 23.82 0.65 Allowed 'General case' 0 C--N 1.289 -2.033 0 O-C-N 121.318 -0.864 . . . . 0.0 109.277 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 83.41 -7.91 1.12 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.915 -0.491 . . . . 0.0 111.958 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -85.72 115.82 63.16 Favored Pre-proline 0 C--N 1.296 -1.738 0 O-C-N 120.966 -1.084 . . . . 0.0 110.763 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 29.1 Cg_exo -53.99 161.92 4.45 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 CA-C-N 120.018 1.042 . . . . 0.0 112.436 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.2 m-85 -171.47 141.68 1.56 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.473 -0.767 . . . . 0.0 109.621 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.0 m -71.21 154.58 41.56 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 104.434 -2.432 . . . . 0.0 104.434 174.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -58.03 -55.32 36.48 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.76 -27.89 1.35 Allowed 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.648 -0.657 . . . . 0.0 109.47 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 52.4 m -85.27 -56.99 3.26 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 2.3 t80 -57.93 -54.23 49.32 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.676 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.06 -39.58 56.33 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.0 108.549 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.594 ' O ' HG21 ' A' ' 75' ' ' THR . 0.7 OUTLIER -54.69 -30.75 56.59 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.533 -0.73 . . . . 0.0 110.036 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.45 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -94.36 -57.48 2.49 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.246 -0.909 . . . . 0.0 111.761 -177.035 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.507 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 5.7 m-85 -88.81 24.58 2.0 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.106 -0.996 . . . . 0.0 110.517 -178.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.507 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 2.3 m . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.029 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.443 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.1 p -79.19 122.63 26.52 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.622 -0.928 . . . . 0.0 110.218 -179.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.443 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -132.85 122.25 24.14 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.624 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.66 134.72 40.51 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.498 -179.275 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.708 HD21 HG22 ' A' ' 84' ' ' ILE . 0.1 OUTLIER -83.66 131.24 34.96 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.244 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -77.57 145.45 36.85 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.069 -1.019 . . . . 0.0 108.589 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.0 t -139.58 130.63 32.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.445 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 43.5 m80 -105.76 103.99 13.61 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.52 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.1 t -75.06 115.51 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 118.514 -1.274 . . . . 0.0 108.668 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.37 -43.02 21.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.323 -0.861 . . . . 0.0 110.227 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 3.2 p-10 -64.26 -11.33 30.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.929 -1.107 . . . . 0.0 109.48 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 27' ' ' LEU . 3.6 mm? -122.6 -24.16 4.98 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.52 ' N ' ' O ' ' A' ' 24' ' ' VAL . 35.8 t-20 73.03 13.29 4.9 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 -177.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.3 mtp180 -89.02 -177.11 5.38 Favored 'General case' 0 C--N 1.307 -1.264 0 O-C-N 121.195 -0.941 . . . . 0.0 109.455 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.445 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 0.8 OUTLIER -138.45 118.46 13.39 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 178.022 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 20.3 t -118.41 155.93 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.716 0.77 . . . . 0.0 110.486 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.425 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.66 131.12 39.16 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.111 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.447 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 1.8 mm? -114.78 112.94 23.57 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.53 -0.732 . . . . 0.0 109.981 -178.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -60.98 104.99 0.42 Allowed 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.5 m -136.0 -169.12 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 121.857 0.837 . . . . 0.0 110.099 -178.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.1 p -142.62 171.16 14.43 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.25 47.1 2.86 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 108.585 -1.806 . . . . 0.0 108.585 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -146.04 0.25 0.82 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.687 -0.89 . . . . 0.0 108.955 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.569 ' O ' HG22 ' A' ' 78' ' ' THR . 1.6 m -90.2 145.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.179 -0.951 . . . . 0.0 109.447 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.534 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -78.91 133.65 36.92 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 177.975 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -36.45 29.03 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 O-C-N 120.546 -1.347 . . . . 0.0 108.022 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.09 -22.37 49.06 Favored Glycine 0 N--CA 1.484 1.861 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.42 -22.94 78.68 Favored Glycine 0 C--O 1.209 -1.463 0 N-CA-C 108.016 -2.033 . . . . 0.0 108.016 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.19 -33.85 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 61' ' ' HIS . 32.6 mtm -51.97 -39.19 58.93 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.666 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -77.11 -59.97 2.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.746 -0.596 . . . . 0.0 111.457 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -46.37 -56.06 6.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.812 -1.18 . . . . 0.0 110.112 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -46.52 -60.94 2.05 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.02 -1.05 . . . . 0.0 109.76 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 53.1 t -53.25 -47.78 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 120.969 -1.082 . . . . 0.0 110.056 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -45.51 -42.98 11.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.133 -0.979 . . . . 0.0 109.816 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.447 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 55.0 mttp -62.94 -43.02 99.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.374 -0.829 . . . . 0.0 110.162 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.441 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -62.0 -66.72 0.5 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.515 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.87 82.57 0.1 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.994 0.902 . . . . 0.0 110.119 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.513 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.2 p -171.41 141.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.571 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -67.43 32.68 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.427 -0.795 . . . . 0.0 109.671 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.614 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 20.1 ttpp -78.76 139.71 38.38 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.849 -1.157 . . . . 0.0 109.552 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -49.96 118.42 2.89 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.381 -0.824 . . . . 0.0 109.352 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.63 ' O ' ' CG ' ' A' ' 61' ' ' HIS . 61.2 m95 -118.94 -23.62 6.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.484 -0.76 . . . . 0.0 110.431 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.419 ' C ' ' H ' ' A' ' 61' ' ' HIS . 0.3 OUTLIER -44.85 -54.35 6.51 Favored 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.678 -1.264 . . . . 0.0 110.122 -179.206 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 49.0 t0 -59.8 -2.96 0.44 Allowed 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.436 -0.79 . . . . 0.0 110.076 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.63 ' CG ' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -75.12 149.53 39.05 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 -179.446 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.4 ' C ' HD22 ' A' ' 63' ' ' LEU . . . -171.32 151.16 3.04 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -94.65 144.6 25.48 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.49 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.7 143.01 50.84 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.544 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -103.96 91.01 3.79 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.054 -1.029 . . . . 0.0 108.668 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.43 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.62 -22.62 14.04 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.227 -0.92 . . . . 0.0 111.205 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.46 ' HB2' ' NE1' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -64.43 -21.77 66.75 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 178.312 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.541 ' C ' HH21 ' A' ' 69' ' ' ARG . 15.3 mmtt -120.67 -12.09 8.93 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.38 -178.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.544 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.0 OUTLIER 52.9 46.53 26.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.006 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.58 -174.14 2.41 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.409 0.623 . . . . 0.0 110.125 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.527 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.57 98.39 5.01 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 177.385 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.18 92.31 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 123.04 1.4 . . . . 0.0 110.121 -176.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -125.71 6.21 7.46 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.006 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -82.59 39.83 0.63 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.463 HG21 ' HD2' ' B' ' 602' ' ' LYS . 13.9 p -46.26 -15.11 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.078 -1.014 . . . . 0.0 110.127 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 7.9 m80 -79.27 43.42 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.154 -0.966 . . . . 0.0 110.253 -179.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -176.86 -142.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.025 -1.047 . . . . 0.0 108.573 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.569 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -152.58 166.34 32.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 119.736 -1.853 . . . . 0.0 111.261 -178.761 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.529 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 6.5 mp -44.76 -59.02 2.72 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -45.64 -36.85 5.13 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.157 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.539 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -62.85 -35.71 80.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.031 -1.068 . . . . 0.0 108.573 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.539 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -92.71 -38.84 11.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.016 -1.053 . . . . 0.0 108.426 178.881 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.85 12.63 8.38 Favored Glycine 0 N--CA 1.5 2.912 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.708 HG22 HD21 ' A' ' 20' ' ' LEU . 68.1 mt -61.04 156.61 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.433 -1.04 . . . . 0.0 108.519 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.462 ' H ' ' HB3' ' A' ' 88' ' ' ALA . 1.4 tp60 -170.77 -174.81 1.66 Allowed 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.74 -25.13 66.25 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.374 -0.829 . . . . 0.0 109.803 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -81.14 -6.08 58.42 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.36 112.82 24.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.691 -0.631 . . . . 0.0 109.451 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.0 mmtp -97.66 116.25 29.51 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.117 -0.989 . . . . 0.0 109.255 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.6 mt -99.62 177.81 5.04 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.627 0.727 . . . . 0.0 109.698 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.49 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 7.6 mt-30 -129.84 167.02 18.78 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -133.49 95.62 3.54 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.217 0 O-C-N 121.944 -0.472 . . . . 0.0 111.275 -176.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.524 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.6 m . . . . . 0 N--CA 1.488 1.464 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -61.36 135.82 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.021 -1.049 . . . . 0.0 110.346 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.504 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.32 103.51 12.76 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 178.34 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.7 t -50.8 126.54 16.12 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 122.144 0.974 . . . . 0.0 109.527 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.12 5.63 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 106.301 -2.719 . . . . 0.0 106.301 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -106.45 -35.44 7.1 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.28 56.63 6.21 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 122.659 1.219 . . . . 0.0 109.972 -178.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -140.6 123.55 9.99 Favored Pre-proline 0 C--N 1.294 -1.845 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -44.41 135.81 8.86 Favored 'Trans proline' 0 N--CA 1.494 1.502 0 CA-C-N 120.509 1.217 . . . . 0.0 114.58 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.524 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -95.19 98.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.8 p -100.91 91.26 4.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.212 -0.93 . . . . 0.0 111.211 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.76 -95.21 0.14 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.356 -2.298 . . . . 0.0 107.356 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.6 mmt-85 -113.4 150.25 32.97 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.4 p -144.71 126.41 15.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.971 -1.081 . . . . 0.0 111.509 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.34 146.74 5.87 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.8 m -118.48 146.63 44.35 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.761 0.791 . . . . 0.0 108.934 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.737 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.17 -129.39 0.26 Allowed 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 121.604 0.716 . . . . 0.0 109.352 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.564 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.8 mtt -65.97 26.42 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.737 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.42 -9.04 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 -178.097 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.1 mtmt -82.17 162.73 22.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt -105.62 174.52 5.85 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -161.21 136.25 7.52 Favored 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.969 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -55.49 114.7 7.74 Favored Pre-proline 0 C--N 1.301 -1.531 0 N-CA-C 105.525 -2.028 . . . . 0.0 105.525 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.455 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 45.2 Cg_exo -45.67 -12.84 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.527 0 CA-C-N 120.237 1.12 . . . . 0.0 111.408 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.855 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.0 mt-10 -95.73 -52.71 3.98 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.988 0.899 . . . . 0.0 110.252 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.519 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.2 m170 -58.35 -4.0 0.33 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.986 -1.071 . . . . 0.0 109.876 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.448 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.4 t80 -128.93 56.35 1.68 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 178.415 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.855 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.0 178.02 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.814 0.816 . . . . 0.0 110.898 -178.664 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.648 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.41 143.82 30.03 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.96 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.74 73.61 5.79 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.505 -2.078 . . . . 0.0 108.905 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 577' ' ' PHE . . . . . 0.447 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 34.9 t80 -154.56 -60.13 0.12 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 102.858 -3.016 . . . . 0.0 102.858 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' B' ' 580' ' ' LYS . 31.9 p -113.96 79.12 1.21 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.534 -2.121 . . . . 0.0 105.413 176.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 0.452 HD23 ' N ' ' B' ' 579' ' ' LEU . 5.9 mt -51.36 14.7 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.019 -0.992 . . . . 0.0 113.272 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -97.11 -36.84 10.35 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.045 -1.66 . . . . 0.0 112.652 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.455 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -159.18 140.93 13.38 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 119.617 -1.927 . . . . 0.0 114.636 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.648 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.2 tp -134.51 169.97 16.47 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.427 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.5 m-20 -145.49 128.16 16.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.335 -0.853 . . . . 0.0 109.073 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -51.2 -21.53 2.09 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.57 -0.707 . . . . 0.0 109.689 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.12 -19.81 60.25 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.56 28.46 3.97 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.569 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.07 105.72 17.97 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 122.932 1.349 . . . . 0.0 110.088 -179.634 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.528 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -97.51 167.76 10.79 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.5 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.8 tt0 -152.61 157.37 40.9 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.558 1.17 . . . . 0.0 110.711 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.629 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.9 OUTLIER -155.35 146.04 22.23 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 178.773 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.47 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.2 OUTLIER 45.86 23.51 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.012 -1.055 . . . . 0.0 109.991 -179.701 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.68 -5.11 1.55 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.715 -0.615 . . . . 0.0 111.078 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 32.6 mttm -89.61 123.17 67.26 Favored Pre-proline 0 C--N 1.295 -1.8 0 O-C-N 121.161 -0.962 . . . . 0.0 109.241 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.486 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.8 Cg_exo -48.63 163.94 0.25 Allowed 'Trans proline' 0 N--CA 1.489 1.243 0 CA-C-N 120.051 1.054 . . . . 0.0 111.941 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' B' ' 588' ' ' LYS . 11.3 m-85 -170.34 138.43 1.58 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.017 -1.052 . . . . 0.0 110.685 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 39.5 m -75.38 157.39 34.27 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 174.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -61.03 -56.69 18.01 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 117.53 -1.668 . . . . 0.0 106.618 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.17 -27.29 0.94 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.582 -0.698 . . . . 0.0 109.552 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 87.9 m -85.06 -59.28 2.38 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.484 -0.76 . . . . 0.0 109.01 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -54.69 -49.48 70.56 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.706 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -55.73 -40.27 72.25 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.463 ' HD2' HG21 ' A' ' 75' ' ' THR . 0.2 OUTLIER -51.14 -28.32 10.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.756 . . . . 0.0 109.52 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.666 HD13 HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -94.08 -57.48 2.52 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.233 -0.917 . . . . 0.0 112.051 -176.947 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.629 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 14.6 m-85 -92.23 22.12 4.69 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.809 -1.182 . . . . 0.0 110.598 -178.205 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.52 ' O ' ' CE1' ' A' ' 76' ' ' HIS . 2.2 m . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.109 -0.995 . . . . 0.0 108.952 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.441 0 N-CA-C 108.648 -1.781 . . . . 0.0 108.648 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 p -97.91 122.07 40.58 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.661 -0.905 . . . . 0.0 109.771 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -127.92 130.11 47.94 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.484 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.612 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -82.98 135.72 34.78 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.189 -0.944 . . . . 0.0 110.013 -179.358 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.48 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.72 131.33 34.58 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.98 144.55 36.65 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 120.9 -1.125 . . . . 0.0 108.326 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.8 t -139.18 108.58 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.749 0.785 . . . . 0.0 110.314 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 14.0 m80 -82.49 105.98 13.99 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.537 ' O ' ' N ' ' A' ' 28' ' ' ASN . 5.4 t -73.45 111.18 7.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 118.807 -1.157 . . . . 0.0 109.607 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.487 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.1 p -76.87 165.58 24.5 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.8 t70 72.81 -44.57 0.6 Allowed 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.506 HD22 ' HD2' ' A' ' 29' ' ' ARG . 5.7 mt -94.25 -31.37 14.12 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' VAL . 31.6 t-20 70.93 17.6 6.25 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.804 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.506 ' HD2' HD22 ' A' ' 27' ' ' LEU . 1.0 OUTLIER -89.13 -179.59 5.93 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.698 -1.251 . . . . 0.0 108.872 179.54 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 3.1 m-20 -139.91 115.41 9.99 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 17.3 t -115.25 157.41 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 CA-C-O 121.536 0.684 . . . . 0.0 109.966 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.483 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 132.76 42.03 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.483 HD22 ' C ' ' A' ' 32' ' ' THR . 3.7 mm? -115.53 112.91 22.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.636 -0.665 . . . . 0.0 110.372 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.65 109.1 0.95 Allowed 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.53 -169.27 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 CA-C-O 121.815 0.817 . . . . 0.0 110.218 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.7 p -143.64 174.55 10.69 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.73 44.01 3.04 Favored Glycine 0 N--CA 1.483 1.801 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.452 ' C ' HG21 ' A' ' 78' ' ' THR . 4.2 pt-20 -145.37 3.82 1.02 Allowed 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.592 ' O ' HG22 ' A' ' 78' ' ' THR . 2.4 m -89.16 143.3 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 120.92 -1.113 . . . . 0.0 110.072 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.511 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -80.16 141.83 35.33 Favored 'General case' 0 C--N 1.293 -1.881 0 O-C-N 120.888 -1.133 . . . . 0.0 108.126 178.794 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.464 ' C ' ' N ' ' A' ' 43' ' ' GLY . 19.6 mt -47.27 -58.32 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.047 -1.033 . . . . 0.0 109.495 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.406 ' H ' HG23 ' A' ' 75' ' ' THR . . . -54.38 -13.59 4.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.023 -2.031 . . . . 0.0 108.023 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.6 -28.47 67.36 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.95 -35.58 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.7 mtm -51.02 -37.72 46.91 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.606 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -70.32 -63.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.836 -0.54 . . . . 0.0 109.843 -179.192 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.429 ' HB2' HD12 ' A' ' 33' ' ' LEU . 32.8 mttt -53.34 -56.54 15.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.942 . . . . 0.0 111.37 -178.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.466 HD21 ' CD2' ' A' ' 92' ' ' PHE . 53.6 tp -45.46 -34.15 3.03 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.846 -1.159 . . . . 0.0 110.215 -177.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 19.4 t -80.46 -44.12 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.985 -1.072 . . . . 0.0 109.114 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -43.11 -33.89 0.96 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.527 0.679 . . . . 0.0 109.969 -178.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mtmt -83.72 -39.76 19.73 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.539 -0.726 . . . . 0.0 110.43 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.431 HD23 ' CG1' ' A' ' 54' ' ' VAL . 10.9 tp -51.23 -60.58 2.96 Favored 'General case' 0 N--CA 1.484 1.249 0 O-C-N 121.133 -0.979 . . . . 0.0 108.969 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 68.73 78.83 0.22 Allowed 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.861 0.838 . . . . 0.0 110.424 178.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.514 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -173.78 142.07 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.463 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.1 tttt -71.28 39.81 0.06 Allowed 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.554 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.7 ttmm -77.47 154.15 32.84 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.53 91.2 7.36 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 0.1 OUTLIER -80.59 -44.17 19.39 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 122.129 0.966 . . . . 0.0 109.015 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.499 ' C ' ' H ' ' A' ' 61' ' ' HIS . 58.4 p -39.82 -55.31 1.99 Allowed 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.166 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -52.41 -8.05 0.07 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.191 -0.943 . . . . 0.0 109.517 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.7 OUTLIER -98.27 173.32 7.05 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 122.319 1.057 . . . . 0.0 110.771 -179.233 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' CD2' ' A' ' 61' ' ' HIS . . . -168.19 162.18 12.73 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.822 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.4 mm? -94.75 145.9 24.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.182 -0.949 . . . . 0.0 109.347 -179.274 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.478 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.11 148.53 50.58 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -106.08 91.07 3.57 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.056 -1.027 . . . . 0.0 108.527 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.406 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.1 pt-20 -55.64 -21.77 19.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.064 -1.023 . . . . 0.0 111.037 -178.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.499 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -66.07 -17.73 64.89 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -125.97 -11.92 6.49 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.623 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.0 mpp_? 53.69 46.41 25.97 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 -177.726 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -113.03 -171.62 1.9 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.365 0.602 . . . . 0.0 109.851 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.552 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.34 99.46 5.43 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.496 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -60.36 82.28 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.926 0 CA-C-O 122.372 1.082 . . . . 0.0 110.673 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -118.33 5.74 11.86 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.414 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.48 55.54 2.32 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.539 HG21 ' O ' ' B' ' 602' ' ' LYS . 12.6 m -47.77 -25.06 1.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.047 -1.033 . . . . 0.0 109.218 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.1 158.32 13.99 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.487 -0.758 . . . . 0.0 109.461 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 45.1 m95 57.34 -138.16 0.94 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.662 -0.649 . . . . 0.0 110.05 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.592 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -155.63 -162.8 1.38 Allowed 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.527 -1.269 . . . . 0.0 111.583 -179.055 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.609 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.6 mp -72.46 -56.34 5.57 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -43.02 -49.41 6.07 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.629 -1.168 . . . . 0.0 111.188 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.54 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -56.63 -30.6 63.47 Favored 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.475 -178.3 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.54 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -82.88 -49.0 10.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.848 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 118.11 7.83 11.05 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.161 -1.976 . . . . 0.0 108.161 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.444 HG22 ' N ' ' A' ' 85' ' ' GLN . 30.3 mt -60.66 161.36 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.502 ' HA ' ' CZ3' ' A' ' 18' ' ' TRP . 1.0 OUTLIER -155.75 -163.06 1.42 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.962 -1.086 . . . . 0.0 109.64 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.88 -24.18 59.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.49 -0.756 . . . . 0.0 110.75 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -84.77 3.17 38.81 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.43 -0.794 . . . . 0.0 109.756 -178.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.48 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -91.72 112.68 24.7 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.543 -0.723 . . . . 0.0 109.332 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -97.78 117.87 33.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.92 -1.113 . . . . 0.0 109.894 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.419 ' HG ' HD12 ' A' ' 20' ' ' LEU . 2.5 mt -103.6 178.01 4.68 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.478 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.7 mt-30 -131.52 157.92 42.28 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -122.79 93.4 3.95 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.817 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.229 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.361 -178.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.538 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.26 136.17 57.95 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.627 -1.296 . . . . 0.0 110.474 -178.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.512 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.4 OUTLIER -83.89 103.51 13.22 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 178.094 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.4 t -52.11 128.83 25.89 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 122.315 1.055 . . . . 0.0 110.872 -176.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.71 -25.43 28.34 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 106.433 -2.667 . . . . 0.0 106.433 -178.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 552' ' ' CYS . . . . . 0.478 ' HB2' ' SG ' ' B' ' 549' ' ' CYS . 2.0 t -112.78 -29.99 7.22 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 553' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' B' ' 549' ' ' CYS . 15.4 mm100 46.88 57.46 5.61 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 122.525 1.155 . . . . 0.0 112.779 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -142.51 125.92 9.47 Favored Pre-proline 0 C--N 1.286 -2.184 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -44.34 134.94 9.05 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 CA-C-N 120.412 1.183 . . . . 0.0 114.596 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.4 mt -94.37 98.04 7.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 5.3 p -100.54 90.94 4.45 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.273 -0.892 . . . . 0.0 111.194 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.11 -96.33 0.16 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.483 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.0 mmt-85 -110.83 150.54 29.0 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 178.174 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.73 126.26 15.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 111.677 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.27 146.49 6.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 178.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.434 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 8.9 m -119.93 146.45 45.79 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.803 0.811 . . . . 0.0 109.02 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.21 -129.29 0.27 Allowed 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.517 0.675 . . . . 0.0 109.538 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.56 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 13.7 mtm -66.09 26.57 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.62 -9.38 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 566' ' ' LYS . . . . . 0.451 ' NZ ' ' CE ' ' B' ' 564' ' ' MET . 13.1 mtmt -81.53 161.14 23.7 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -103.29 174.4 5.88 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.11 134.9 7.74 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.207 -1.397 . . . . 0.0 109.911 -179.115 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.556 ' O ' ' N ' ' B' ' 571' ' ' GLU . 4.4 m80 -55.84 114.9 8.28 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 176.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.451 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.22 -12.49 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.534 0 CA-C-N 120.47 1.204 . . . . 0.0 110.703 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.844 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.5 mt-10 -94.57 -52.46 4.3 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.046 0.927 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.534 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -60.67 -3.67 0.77 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.958 -1.089 . . . . 0.0 109.812 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.414 ' H ' ' C ' ' B' ' 571' ' ' GLU . 25.5 t80 -128.84 55.78 1.7 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.844 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.4 m -94.52 178.2 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-O 121.85 0.833 . . . . 0.0 111.24 -178.398 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.658 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.8 142.59 30.54 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.76 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -92.6 75.22 5.07 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 116.717 -1.993 . . . . 0.0 109.289 178.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -153.05 -51.58 0.1 Allowed 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 102.413 -3.18 . . . . 0.0 102.413 173.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.553 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.1 p -129.64 80.53 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.94 -2.391 . . . . 0.0 105.299 177.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.85 15.1 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -176.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.553 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.99 -37.22 16.54 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 119.733 -1.854 . . . . 0.0 112.112 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.451 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.3 tp-100 -160.13 139.82 11.23 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 119.624 -1.923 . . . . 0.0 114.907 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.8 tp -135.81 169.35 17.7 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 71.2 m-20 -142.53 143.34 32.46 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.333 -0.855 . . . . 0.0 108.891 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.434 ' HE3' ' H ' ' B' ' 562' ' ' THR . 11.4 ptpt -64.14 -17.24 63.28 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.478 -0.763 . . . . 0.0 109.773 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.59 -17.14 55.56 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.08 27.14 4.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.933 -0.745 . . . . 0.0 109.363 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.517 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -88.72 111.24 21.74 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.593 1.187 . . . . 0.0 109.331 179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.514 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.76 168.89 8.95 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.8 tt0 -151.84 157.07 41.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.729 -1.232 . . . . 0.0 110.797 -178.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.469 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 2.5 tp60 -158.59 146.45 18.12 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 178.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.24 22.56 0.45 Allowed 'General case' 0 C--N 1.295 -1.783 0 O-C-N 120.911 -1.118 . . . . 0.0 109.547 -179.434 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 0.8 OUTLIER 79.44 -3.69 2.08 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.732 -0.605 . . . . 0.0 110.933 178.519 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -91.03 125.44 58.74 Favored Pre-proline 0 C--N 1.294 -1.81 0 O-C-N 121.265 -0.897 . . . . 0.0 109.39 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.6 Cg_exo -48.87 165.77 0.17 Allowed 'Trans proline' 0 N--CA 1.492 1.404 0 CA-C-N 120.15 1.089 . . . . 0.0 111.955 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.0 m-85 -171.1 136.89 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.9 -1.125 . . . . 0.0 111.066 -178.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 23.3 m -73.05 154.55 40.4 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -59.77 -58.14 9.85 Favored 'General case' 0 C--N 1.288 -2.081 0 C-N-CA 117.525 -1.67 . . . . 0.0 106.582 179.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -46.04 -26.17 0.69 Allowed 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -85.36 -64.48 1.15 Allowed 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.533 -0.73 . . . . 0.0 109.389 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -50.98 -53.56 32.06 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.847 . . . . 0.0 108.856 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.719 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -50.51 -41.87 54.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.539 ' O ' HG21 ' A' ' 75' ' ' THR . 0.2 OUTLIER -53.38 -24.42 12.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.452 -0.78 . . . . 0.0 109.087 179.558 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.606 HD13 HD12 ' A' ' 46' ' ' LEU . 3.6 mt -94.16 -56.97 2.66 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.281 -0.887 . . . . 0.0 111.5 -178.016 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.515 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 51.7 m-85 -105.1 -28.49 10.98 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.136 -0.978 . . . . 0.0 110.953 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.2 p . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.949 -179.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.574 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -76.92 126.55 31.16 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.416 -1.05 . . . . 0.0 110.379 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.4 ' CD2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -130.68 119.76 22.88 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 177.89 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.9 127.83 33.9 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.11 -1.036 . . . . 0.0 109.008 -179.375 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.54 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -83.52 134.3 34.84 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 179.447 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 t -78.21 145.68 35.4 Favored 'General case' 0 C--N 1.294 -1.822 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.433 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.5 t -136.81 105.3 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 CA-C-O 121.817 0.817 . . . . 0.0 109.525 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.53 ' CD2' ' OD2' ' A' ' 30' ' ' ASP . 12.1 m80 -78.79 103.71 8.92 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 178.253 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.5 t -72.28 113.3 9.23 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 118.613 -1.235 . . . . 0.0 107.972 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.477 ' C ' ' H ' ' A' ' 27' ' ' LEU . 30.3 p -80.84 -36.94 30.83 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.392 -0.817 . . . . 0.0 109.873 -178.467 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -71.34 9.55 0.77 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.946 -1.096 . . . . 0.0 108.654 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.9 mt -147.06 -29.07 0.37 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.585 -0.697 . . . . 0.0 109.294 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 24' ' ' VAL . 26.9 t-20 80.78 12.5 0.84 Allowed 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -94.29 -178.26 4.54 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.997 -1.065 . . . . 0.0 109.495 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.53 ' OD2' ' CD2' ' A' ' 23' ' ' HIS . 3.5 m-20 -136.0 114.99 12.24 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 25.8 t -112.35 157.59 13.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.493 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -132.46 133.99 44.53 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.493 HD22 ' C ' ' A' ' 32' ' ' THR . 3.6 mm? -113.76 113.01 24.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.645 -0.659 . . . . 0.0 109.695 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.574 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 14.7 tpt180 -60.12 102.38 0.16 Allowed 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 23.8 m -132.96 -169.75 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 CA-C-O 121.918 0.866 . . . . 0.0 110.854 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.3 p -145.26 176.43 9.55 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.33 46.58 3.04 Favored Glycine 0 C--N 1.295 -1.729 0 N-CA-C 109.153 -1.579 . . . . 0.0 109.153 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.439 ' C ' HG21 ' A' ' 78' ' ' THR . 4.2 pt-20 -147.01 0.23 0.72 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.203 -1.175 . . . . 0.0 108.669 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 m -89.76 128.21 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 120.97 -1.081 . . . . 0.0 109.691 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 43' ' ' GLY . 7.6 m80 -66.92 144.15 56.41 Favored 'General case' 0 C--N 1.291 -1.957 0 O-C-N 121.001 -1.062 . . . . 0.0 108.887 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.519 HD13 ' HB3' ' A' ' 72' ' ' LEU . 96.4 mt -46.22 -56.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.194 -0.941 . . . . 0.0 109.365 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.591 ' H ' HG23 ' A' ' 75' ' ' THR . . . -57.24 -14.86 13.0 Favored Glycine 0 C--N 1.296 -1.661 0 N-CA-C 108.741 -1.744 . . . . 0.0 108.741 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.29 -18.69 77.86 Favored Glycine 0 N--CA 1.485 1.905 0 N-CA-C 109.131 -1.588 . . . . 0.0 109.131 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 t -83.41 -50.76 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.385 -1.068 . . . . 0.0 109.063 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.6 mtm -50.41 -39.66 47.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.867 -1.145 . . . . 0.0 108.542 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.704 HD12 HD13 ' B' ' 603' ' ' LEU . 6.7 tt -56.98 -53.87 53.19 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.41 ' CB ' HD12 ' A' ' 33' ' ' LEU . 55.1 mttm -67.27 -52.84 35.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.12 -0.988 . . . . 0.0 110.7 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.1 tp -44.77 -40.48 6.11 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.142 -0.974 . . . . 0.0 110.163 -178.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.5 t -78.07 -45.68 27.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.927 -1.108 . . . . 0.0 109.952 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -44.67 -37.43 3.67 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.349 -0.844 . . . . 0.0 109.831 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.523 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.8 mtmp? -75.87 -39.04 57.25 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.46 -0.775 . . . . 0.0 110.775 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.442 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -62.03 -67.56 0.4 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.039 -1.038 . . . . 0.0 109.089 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.76 80.83 0.1 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.97 0.891 . . . . 0.0 110.142 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.497 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.3 p -172.52 142.06 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -68.04 31.83 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.0 110.833 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.497 ' H ' ' C ' ' A' ' 54' ' ' VAL . 1.6 tppp? -79.86 142.15 35.49 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.859 -1.151 . . . . 0.0 108.268 178.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -60.0 115.77 3.67 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.477 -0.765 . . . . 0.0 110.03 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.424 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 71.2 m95 -119.67 -43.79 2.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.569 -0.707 . . . . 0.0 109.788 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -48.67 -56.04 9.63 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.954 -1.091 . . . . 0.0 110.094 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.62 -36.84 47.46 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.133 -0.979 . . . . 0.0 108.904 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.408 ' O ' ' CZ ' ' A' ' 92' ' ' PHE . 14.7 m170 -72.49 128.02 34.34 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.888 0.851 . . . . 0.0 110.586 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.68 160.11 27.89 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.496 ' HA ' ' O ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER -99.7 148.63 24.16 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-O 122.274 1.035 . . . . 0.0 110.031 -178.65 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.47 ' CD1' ' C ' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.07 151.28 48.83 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.191 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.647 ' HB2' HD21 ' A' ' 72' ' ' LEU . 5.2 t90 -100.73 90.5 4.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.8 -1.188 . . . . 0.0 108.674 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.416 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 9.2 pt-20 -54.59 -23.17 15.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.17 -0.956 . . . . 0.0 110.91 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.504 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 15.7 mmtp -67.48 -10.7 53.97 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -133.93 -11.48 2.62 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.1 mpp_? 52.92 45.92 27.81 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 5.0 t -111.81 -169.91 1.55 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.282 0.563 . . . . 0.0 109.933 -178.348 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.489 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -128.24 103.9 7.44 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 177.707 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 65' ' ' TRP . 10.1 mt -63.23 82.57 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.468 0 O-C-N 120.479 -1.388 . . . . 0.0 110.318 -176.394 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.2 pp -113.59 15.19 18.98 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HZ1' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -84.22 61.11 6.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.647 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.591 HG23 ' H ' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -75.12 -5.86 46.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.066 -1.021 . . . . 0.0 109.419 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.423 ' ND1' ' N ' ' A' ' 76' ' ' HIS . 6.4 m80 -68.79 -53.04 23.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.338 -0.852 . . . . 0.0 110.782 -179.068 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -97.24 -128.31 0.16 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -153.33 150.79 29.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.411 -1.431 . . . . 0.0 108.867 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.678 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -40.1 -49.32 2.58 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.504 -0.748 . . . . 0.0 111.224 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.452 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 23.0 t70 -46.91 -34.78 5.76 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.187 -0.945 . . . . 0.0 109.413 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.492 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -66.77 -30.44 70.65 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.534 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -79.31 -51.66 9.14 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.048 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.6 9.9 5.66 Favored Glycine 0 N--CA 1.51 3.598 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 53.2 mt -60.87 161.86 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 O-C-N 122.2 -0.588 . . . . 0.0 109.446 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -162.53 -159.02 0.54 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.255 -0.903 . . . . 0.0 109.279 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.68 -26.05 60.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.329 -0.857 . . . . 0.0 109.732 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -79.83 -1.81 40.64 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.111 -179.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.5 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.35 113.48 25.82 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.523 -0.736 . . . . 0.0 109.059 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -98.05 115.43 28.21 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.897 -1.127 . . . . 0.0 110.255 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.54 ' HG ' HD12 ' A' ' 20' ' ' LEU . 8.1 mt -91.54 176.29 6.6 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.496 ' O ' ' HA ' ' A' ' 63' ' ' LEU . 2.6 mt-30 -142.27 148.24 37.75 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.408 ' CZ ' ' O ' ' A' ' 61' ' ' HIS . 10.0 t80 -111.34 90.88 3.46 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.235 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.531 -178.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.27 136.71 58.12 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.887 -1.133 . . . . 0.0 110.527 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.553 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.1 OUTLIER -83.72 102.86 12.57 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 105.571 -2.011 . . . . 0.0 105.571 178.358 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.21 127.5 14.86 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.175 0.988 . . . . 0.0 110.654 -177.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.57 -26.2 25.47 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 106.788 -2.525 . . . . 0.0 106.788 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 552' ' ' CYS . . . . . 0.432 ' CB ' ' SG ' ' B' ' 549' ' ' CYS . 6.4 t -110.51 -30.93 7.43 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 553' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' B' ' 549' ' ' CYS . 15.4 mm100 47.46 57.04 6.24 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-O 122.711 1.243 . . . . 0.0 112.02 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 37.3 mmtm -142.44 125.58 9.38 Favored Pre-proline 0 C--N 1.287 -2.135 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -44.03 136.41 7.62 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.415 1.184 . . . . 0.0 114.582 -178.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.553 HD11 ' HA ' ' B' ' 549' ' ' CYS . 43.8 mt -94.9 98.41 7.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 3.6 p -99.48 91.01 4.71 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.998 0.904 . . . . 0.0 111.179 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.06 -96.82 0.16 Allowed Glycine 0 N--CA 1.488 2.126 0 N-CA-C 107.675 -2.17 . . . . 0.0 107.675 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.12 153.31 28.42 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 20.7 p -144.09 126.5 15.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.014 -1.054 . . . . 0.0 111.558 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 51.6 mt -90.03 145.52 7.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.472 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 9.8 m -121.95 146.38 47.2 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-O 121.965 0.888 . . . . 0.0 109.193 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.742 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.34 -128.85 0.26 Allowed 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.8 mtt -65.44 25.63 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.593 -0.692 . . . . 0.0 109.255 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.742 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.07 -8.66 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 -178.082 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.57 148.94 28.87 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.124 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -95.13 174.19 7.19 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -159.95 132.05 6.3 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 118.56 -1.256 . . . . 0.0 109.81 -179.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.569 ' O ' ' N ' ' B' ' 571' ' ' GLU . 1.4 m80 -54.56 117.83 14.74 Favored Pre-proline 0 C--N 1.299 -1.593 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 176.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.436 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 32.1 Cg_exo -48.6 -9.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.303 -1.828 0 CA-C-N 120.48 1.207 . . . . 0.0 110.272 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.899 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.0 mt-10 -97.58 -52.85 3.63 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.62 0.724 . . . . 0.0 110.56 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -59.96 -2.72 0.44 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.612 -1.305 . . . . 0.0 109.685 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.445 ' H ' ' C ' ' B' ' 571' ' ' GLU . 5.8 t80 -128.06 56.6 1.59 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 178.064 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.899 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.0 m -95.1 177.82 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 CA-C-O 121.718 0.77 . . . . 0.0 111.5 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.619 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.87 145.86 30.15 Favored 'General case' 0 N--CA 1.505 2.303 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.72 76.33 3.22 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 116.915 -1.914 . . . . 0.0 109.949 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -152.57 -60.53 0.15 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 101.252 -3.61 . . . . 0.0 101.252 173.096 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 21.5 p -121.04 81.51 1.79 Allowed 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 111.659 -2.518 . . . . 0.0 104.803 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 0.461 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.9 mp -53.62 16.88 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -176.549 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.0 -36.9 19.49 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.585 -1.947 . . . . 0.0 112.522 -178.613 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.3 tp-100 -159.27 140.09 12.57 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 119.465 -2.022 . . . . 0.0 115.073 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.619 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.3 tp -139.99 170.48 15.78 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 175.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.5 m-20 -149.38 134.55 18.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.101 -1.0 . . . . 0.0 109.098 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.472 ' CE ' ' O ' ' B' ' 562' ' ' THR . 12.3 ptpt -51.91 -19.37 1.73 Allowed 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.456 -0.778 . . . . 0.0 109.634 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -18.26 55.73 Favored Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -134.05 25.41 3.91 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.557 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.3 109.01 20.12 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 122.5 1.143 . . . . 0.0 110.232 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -104.58 169.0 8.72 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.3 tt0 -152.38 157.23 40.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.678 -1.264 . . . . 0.0 110.781 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.432 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 2.8 tp60 -155.0 146.44 23.06 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 178.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.486 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.2 OUTLIER 45.56 23.65 0.15 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.997 -1.064 . . . . 0.0 109.909 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 82.49 -5.95 1.35 Allowed 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.816 -0.553 . . . . 0.0 110.768 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -90.27 118.91 69.18 Favored Pre-proline 0 C--N 1.295 -1.78 0 O-C-N 121.158 -0.964 . . . . 0.0 109.652 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.522 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 38.2 Cg_exo -49.27 164.98 0.25 Allowed 'Trans proline' 0 N--CA 1.491 1.335 0 CA-C-N 119.996 1.034 . . . . 0.0 112.288 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.522 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 22.5 m-85 -170.8 139.58 1.52 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.224 -0.923 . . . . 0.0 109.866 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.1 m -70.02 154.63 41.7 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -58.08 -55.53 33.79 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.98 -29.32 4.68 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.41 -58.47 3.11 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.613 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -60.27 -59.48 5.35 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.81 -0.556 . . . . 0.0 110.246 -179.764 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.71 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.55 -38.7 9.79 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.366 -0.834 . . . . 0.0 109.36 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.531 ' O ' HG21 ' A' ' 75' ' ' THR . 17.4 tptm -63.19 -20.71 65.66 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.542 -0.724 . . . . 0.0 110.855 -179.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.704 HD13 HD12 ' A' ' 46' ' ' LEU . 3.0 mt -92.11 -57.3 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.75 -1.219 . . . . 0.0 111.239 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.49 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 10.5 m-85 -96.07 12.03 32.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.16 -0.963 . . . . 0.0 109.905 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.49 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 26.4 m . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.25 179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.351 0 N-CA-C 108.198 -1.961 . . . . 0.0 108.198 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.502 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 21.8 p -89.98 124.14 34.49 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.809 -0.818 . . . . 0.0 110.619 -178.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -119.0 122.15 41.52 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 177.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.626 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -79.37 128.78 33.76 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.106 -0.996 . . . . 0.0 109.975 -178.837 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.5 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.47 133.96 34.46 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.776 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.81 34.59 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -178.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.4 t -135.31 107.31 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 CA-C-O 121.802 0.81 . . . . 0.0 109.117 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.62 103.71 8.75 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.33 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -71.24 98.92 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 27' ' ' LEU . 19.7 p -68.19 -48.56 64.91 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.826 -0.546 . . . . 0.0 111.161 -177.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.91 12.22 0.23 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.753 -1.217 . . . . 0.0 109.698 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.498 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -141.36 -24.98 0.72 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 24' ' ' VAL . 27.5 t-20 77.15 13.25 2.08 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 122.041 -0.412 . . . . 0.0 110.234 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.5 mtp-105 -96.92 -178.16 4.13 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 120.966 -1.084 . . . . 0.0 109.687 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -137.51 114.23 10.47 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.435 HG12 ' N ' ' A' ' 32' ' ' THR . 30.3 t -110.65 157.65 11.35 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.401 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.593 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -131.72 135.3 46.73 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.495 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.594 HD22 ' N ' ' A' ' 33' ' ' LEU . 3.8 mm? -109.15 110.44 21.67 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.685 -0.634 . . . . 0.0 109.416 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.502 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.9 tpt180 -60.87 101.73 0.16 Allowed 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.7 m -133.55 -169.63 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-O 122.187 0.994 . . . . 0.0 110.742 -178.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.7 p -142.4 174.51 10.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.26 45.51 3.04 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.442 ' C ' HG21 ' A' ' 78' ' ' THR . 1.4 pp20? -146.61 4.87 0.9 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.595 -0.944 . . . . 0.0 108.948 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.596 ' O ' HG22 ' A' ' 78' ' ' THR . 2.5 m -89.83 138.28 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.122 -0.986 . . . . 0.0 110.335 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.487 ' O ' ' N ' ' A' ' 43' ' ' GLY . 2.6 m80 -82.0 146.12 29.88 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.025 -1.047 . . . . 0.0 108.585 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 73.7 mt -47.36 -56.5 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.953 -1.092 . . . . 0.0 109.896 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.02 -14.89 4.57 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.378 -1.889 . . . . 0.0 108.378 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.487 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.08 -27.49 58.06 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 108.511 -1.835 . . . . 0.0 108.511 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.405 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.18 -39.32 19.15 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.433 ' O ' HG23 ' A' ' 49' ' ' VAL . 38.6 mtm -51.39 -40.05 58.44 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -62.95 -58.41 7.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.623 -0.673 . . . . 0.0 109.931 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.492 ' HB2' HD12 ' A' ' 33' ' ' LEU . 54.7 mttm -54.95 -59.75 4.31 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.425 -0.797 . . . . 0.0 111.234 -178.474 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.7 tp -45.51 -38.26 6.13 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.958 -1.089 . . . . 0.0 109.716 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.714 HG22 ' CD2' ' A' ' 58' ' ' TRP . 54.0 t -70.24 -53.93 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -45.34 -47.25 13.32 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.188 0.518 . . . . 0.0 110.975 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.593 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 7.3 mtmp? -60.85 -58.06 10.06 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.229 -0.919 . . . . 0.0 110.634 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.6 tp -55.52 -49.99 71.15 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 t70 66.05 74.96 0.35 Allowed 'General case' 0 C--N 1.299 -1.617 0 CA-C-O 121.805 0.812 . . . . 0.0 109.989 178.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.428 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.31 144.68 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.999 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.979 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' CB ' ' B' ' 576' ' ' ALA . 20.6 mmtt -71.84 45.29 0.11 Allowed 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.535 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 40.8 tttm -76.26 171.18 14.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.415 -0.803 . . . . 0.0 110.429 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 8.4 m-20 -50.89 91.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.366 -0.833 . . . . 0.0 110.357 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.714 ' CD2' HG22 ' A' ' 49' ' ' VAL . 67.7 m95 -113.55 -13.51 12.76 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 122.282 1.039 . . . . 0.0 109.102 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.6 t -57.39 -54.11 50.47 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-O 121.778 0.799 . . . . 0.0 109.787 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.432 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 54.5 t0 -91.26 12.56 19.86 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.76 -0.588 . . . . 0.0 110.684 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.46 134.77 48.09 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.124 -0.985 . . . . 0.0 110.023 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.74 148.52 4.36 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.3 mm? -95.6 148.35 22.61 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.859 -1.151 . . . . 0.0 110.611 -178.834 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.528 ' HE1' ' CA ' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -129.94 137.65 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -99.7 91.67 4.97 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.528 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 16.5 pt-20 -57.51 -22.01 41.53 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.965 -1.084 . . . . 0.0 110.553 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.494 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -62.95 -13.38 34.05 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 177.762 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.444 ' N ' ' C ' ' A' ' 66' ' ' GLU . 18.9 mmtt -130.85 -12.8 3.71 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.477 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.4 mpp_? 54.11 45.9 26.52 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 -177.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.61 -175.42 2.67 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.647 0.737 . . . . 0.0 109.957 -178.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.467 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.67 102.35 7.3 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 177.655 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' A' ' 41' ' ' ILE . 28.8 mt -62.01 87.01 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.262 0 O-C-N 120.431 -1.418 . . . . 0.0 110.433 -176.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.7 pp -124.52 10.91 8.54 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 82.61 7.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.209 -0.932 . . . . 0.0 108.895 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.417 HG21 ' O ' ' B' ' 602' ' ' LYS . 0.2 OUTLIER -75.47 -12.06 60.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.095 -1.003 . . . . 0.0 109.984 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.521 ' O ' ' CG ' ' A' ' 77' ' ' TRP . 0.6 OUTLIER -90.78 44.07 1.18 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.866 -1.147 . . . . 0.0 109.468 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.521 ' CG ' ' O ' ' A' ' 76' ' ' HIS . 1.3 m0 -173.42 -169.87 0.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.059 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.698 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -139.97 -169.19 2.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.898 -1.126 . . . . 0.0 109.692 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.533 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.8 mp -65.25 -60.0 3.47 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -45.68 -52.83 10.24 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.857 0.837 . . . . 0.0 109.804 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.698 ' CG ' ' H ' ' A' ' 78' ' ' THR . 36.7 mmtt -45.43 -55.96 5.53 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.639 0.733 . . . . 0.0 109.731 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -41.73 69.63 Favored 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 119.827 -0.749 . . . . 0.0 109.155 -179.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.3 11.53 6.73 Favored Glycine 0 N--CA 1.5 2.908 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.475 HG22 ' N ' ' A' ' 85' ' ' GLN . 43.1 mt -71.23 160.71 5.08 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.606 -0.937 . . . . 0.0 109.513 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.475 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.6 tp60 -170.76 -165.15 0.42 Allowed 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.94 -22.23 62.25 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.417 -0.802 . . . . 0.0 110.098 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -79.93 -10.0 59.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.157 -0.964 . . . . 0.0 108.844 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.468 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.93 112.83 25.09 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.9 115.59 27.97 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 109.964 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.5 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.4 mt -90.12 176.22 6.85 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.466 ' NE2' ' CZ2' ' A' ' 64' ' ' TRP . 1.2 mt-30 -140.63 148.93 41.64 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.1 OUTLIER -96.0 142.52 28.11 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.1 t . . . . . 0 N--CA 1.496 1.846 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 179.449 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.3 mp -59.38 135.56 57.69 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.888 -1.133 . . . . 0.0 110.653 -178.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.499 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.89 103.97 13.59 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.267 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 18.3 t -51.65 127.21 19.83 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.201 1.001 . . . . 0.0 109.659 -177.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.74 -34.21 5.6 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.142 -2.783 . . . . 0.0 106.142 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.1 m -106.23 -36.2 6.95 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.72 56.37 6.21 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 122.639 1.209 . . . . 0.0 109.942 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.7 mmtm -140.53 124.06 10.32 Favored Pre-proline 0 N--CA 1.496 1.851 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -44.2 135.17 8.58 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 120.492 1.211 . . . . 0.0 114.855 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.54 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.8 mt -94.04 99.3 9.31 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 80.9 p -100.82 91.7 4.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.307 -0.871 . . . . 0.0 111.238 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.96 -96.59 0.16 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 107.334 -2.306 . . . . 0.0 107.334 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.489 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.3 mmt-85 -112.12 152.9 27.75 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.4 p -145.18 126.13 14.5 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.978 -1.076 . . . . 0.0 111.577 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.8 mt -90.54 146.07 6.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 178.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.468 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 8.9 m -120.0 146.54 45.76 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 121.916 0.865 . . . . 0.0 109.283 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.723 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.19 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.803 0 CA-C-O 121.605 0.717 . . . . 0.0 109.406 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.548 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.1 mtt -65.66 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.688 0 O-C-N 121.617 -0.677 . . . . 0.0 109.272 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.723 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.46 -9.05 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.17 159.99 24.49 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -103.84 174.68 5.77 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -160.09 133.58 6.98 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.268 -1.373 . . . . 0.0 110.005 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.568 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -54.16 114.3 6.35 Favored Pre-proline 0 C--N 1.302 -1.49 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.432 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 36.8 Cg_exo -46.96 -9.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.422 0 CA-C-N 120.331 1.154 . . . . 0.0 111.535 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.877 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.9 mt-10 -98.69 -52.92 3.45 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.011 0.91 . . . . 0.0 110.008 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.559 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -56.91 -4.86 0.19 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.917 -1.114 . . . . 0.0 109.87 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 573' ' ' PHE . . . . . 0.466 ' H ' ' C ' ' B' ' 571' ' ' GLU . 30.1 t80 -125.47 53.7 1.53 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.877 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.9 m -93.1 178.26 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 122.17 0.986 . . . . 0.0 110.487 -178.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.627 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.42 150.93 28.14 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.21 -179.499 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 576' ' ' ALA . . . . . 0.568 ' CB ' ' NZ ' ' A' ' 55' ' ' LYS . . . -96.24 76.85 3.03 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 117.219 -1.792 . . . . 0.0 110.031 178.723 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 577' ' ' PHE . . . . . 0.433 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 27.9 t80 -152.65 -44.38 0.1 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 173.655 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.2 p -137.3 125.62 23.28 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 111.71 -2.495 . . . . 0.0 106.624 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.78 13.72 0.78 Allowed 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.055 -1.028 . . . . 0.0 111.84 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.449 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -91.93 -39.7 11.56 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-N 121.614 2.007 . . . . 0.0 115.204 -175.272 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.4 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.2 tp-100 -162.97 141.91 8.6 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 122.377 2.353 . . . . 0.0 116.09 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.627 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.9 tp -140.38 168.66 19.29 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 174.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 68.7 m-20 -147.67 134.98 20.62 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.066 -1.021 . . . . 0.0 109.163 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.468 ' CE ' ' O ' ' B' ' 562' ' ' THR . 11.3 ptpt -55.4 -14.13 1.77 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.73 0.776 . . . . 0.0 109.53 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -95.62 -14.97 45.04 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.6 p -136.41 26.79 3.14 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.94 -0.741 . . . . 0.0 109.083 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.575 ' HA ' HD11 ' B' ' 582' ' ' LEU . 2.8 p90 -88.25 109.39 19.9 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 122.32 1.057 . . . . 0.0 109.176 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.88 159.35 15.14 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.442 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.5 tt0 -155.24 157.25 37.0 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 122.699 1.237 . . . . 0.0 111.456 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.442 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 17.7 pt20 -160.9 146.19 14.33 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.547 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.32 22.97 1.54 Allowed 'General case' 0 C--N 1.287 -2.129 0 O-C-N 121.263 -0.898 . . . . 0.0 109.155 -178.572 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.57 -7.07 1.47 Allowed 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.775 -0.578 . . . . 0.0 111.819 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -87.83 116.12 65.18 Favored Pre-proline 0 C--N 1.294 -1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 110.643 -178.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 34.6 Cg_exo -53.05 164.31 1.75 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 CA-C-N 119.883 0.994 . . . . 0.0 112.147 178.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.0 m-85 -171.04 139.91 1.46 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.287 -0.883 . . . . 0.0 110.229 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.53 155.14 40.96 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 103.529 -2.767 . . . . 0.0 103.529 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -59.15 -55.91 28.95 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.35 -26.97 0.92 Allowed 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.682 -0.636 . . . . 0.0 109.455 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 23.2 m -84.8 -60.23 2.12 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.479 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.6 OUTLIER -55.76 -54.66 41.68 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.684 . . . . 0.0 109.273 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.652 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.71 -41.79 32.99 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.628 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.417 ' O ' HG21 ' A' ' 75' ' ' THR . 0.4 OUTLIER -52.78 -26.95 15.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 109.016 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.3 mt -92.68 -57.25 2.73 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.195 -0.941 . . . . 0.0 111.25 -177.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' O ' ' B' ' 605' ' ' CYS . 11.6 m-85 -102.08 32.13 3.62 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.318 -0.864 . . . . 0.0 110.022 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.409 ' O ' ' O ' ' B' ' 604' ' ' PHE . 9.5 t . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 117.923 -1.037 . . . . 0.0 109.713 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.492 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.491 2.347 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 p -85.67 122.86 30.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.611 -0.934 . . . . 0.0 110.427 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.492 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -137.81 122.52 18.69 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.788 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.617 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.74 130.11 36.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.225 -0.922 . . . . 0.0 108.717 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.491 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.6 133.7 34.83 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.2 145.5 35.53 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.242 -0.911 . . . . 0.0 109.62 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.5 t -138.16 106.25 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-O 121.9 0.857 . . . . 0.0 109.683 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -80.62 103.71 10.66 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.577 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.2 t -72.41 103.48 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.516 ' O ' ' N ' ' A' ' 27' ' ' LEU . 4.1 p -69.03 -65.55 0.69 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 110.89 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' N ' ' OG1' ' A' ' 25' ' ' THR . 25.7 t70 -49.35 -9.25 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.047 -1.033 . . . . 0.0 110.393 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 25' ' ' THR . 2.2 mt -120.86 -23.76 5.83 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.383 -0.823 . . . . 0.0 108.941 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 24' ' ' VAL . 28.2 t-20 74.27 13.92 3.82 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 122.143 -0.348 . . . . 0.0 110.406 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.425 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 56.6 mtp85 -97.25 -178.53 4.2 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.925 -1.11 . . . . 0.0 109.791 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 29' ' ' ARG . 83.7 m-20 -138.39 118.24 13.26 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 32' ' ' THR . 16.6 t -120.47 157.9 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.557 0.694 . . . . 0.0 109.629 -179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.445 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.11 136.63 45.94 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.445 HD22 ' C ' ' A' ' 32' ' ' THR . 3.2 mm? -114.46 113.04 23.94 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -60.28 101.97 0.15 Allowed 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 179.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.9 m -132.59 -174.9 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 CA-C-O 121.925 0.869 . . . . 0.0 110.316 -178.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 p -141.11 175.56 9.53 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.59 49.02 3.3 Favored Glycine 0 C--N 1.292 -1.882 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.406 ' HA ' HG21 ' A' ' 78' ' ' THR . 0.7 OUTLIER -145.72 -4.65 0.66 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.44 -1.036 . . . . 0.0 109.021 -179.952 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.531 ' O ' HG22 ' A' ' 78' ' ' THR . 1.2 m -87.5 150.29 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.162 -0.961 . . . . 0.0 110.455 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.3 138.72 31.31 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.517 HD13 ' HB3' ' A' ' 72' ' ' LEU . 38.7 mt -50.58 -49.03 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.953 -1.092 . . . . 0.0 108.499 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.509 ' H ' ' HB ' ' A' ' 75' ' ' THR . . . -53.49 -13.76 3.04 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 108.287 -1.925 . . . . 0.0 108.287 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.468 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -79.67 -38.56 20.08 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 108.155 -1.978 . . . . 0.0 108.155 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.61 -43.21 94.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.4 mtm -50.95 -32.78 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -77.94 -64.06 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.228 0.537 . . . . 0.0 109.939 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -51.63 -59.38 4.34 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.193 -0.942 . . . . 0.0 110.863 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.82 -55.25 5.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.151 -0.968 . . . . 0.0 108.78 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.412 HG13 ' CE2' ' A' ' 58' ' ' TRP . 14.2 t -56.81 -52.42 54.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 O-C-N 121.839 -0.538 . . . . 0.0 109.589 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -44.55 -40.51 5.75 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.204 -0.935 . . . . 0.0 110.159 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.471 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -71.66 -27.9 63.38 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.618 HD21 ' NZ ' ' A' ' 56' ' ' LYS . 7.2 tp -65.75 -58.63 5.21 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.186 -0.946 . . . . 0.0 109.031 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t0 69.17 72.06 0.26 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.765 0.793 . . . . 0.0 110.698 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.528 ' C ' ' H ' ' A' ' 56' ' ' LYS . 3.1 p -175.25 138.62 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.96 34.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.13 -0.981 . . . . 0.0 109.641 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.618 ' NZ ' HD21 ' A' ' 52' ' ' LEU . 6.6 ttpm? -78.03 168.81 19.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.041 -1.037 . . . . 0.0 109.469 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.457 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -50.17 109.36 0.29 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.455 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 44.3 m0 -103.83 -89.47 0.4 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 61' ' ' HIS . 4.9 t -43.6 -48.21 7.59 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.17 -0.956 . . . . 0.0 110.492 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' SER . 9.0 t0 -43.7 -19.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 1.6 p-80 -88.52 167.52 13.36 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 122.021 0.915 . . . . 0.0 109.821 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.54 153.12 4.97 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -94.07 147.16 23.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.973 -1.08 . . . . 0.0 109.288 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TRP . . . . . 0.525 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -133.27 137.02 45.86 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.719 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -96.46 91.28 5.73 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.477 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 13.3 pt-20 -57.16 -21.99 36.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.806 -1.184 . . . . 0.0 110.197 -178.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -62.16 -15.3 45.14 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 177.88 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.461 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -130.3 -12.56 4.01 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.755 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.516 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.2 mpp_? 54.42 45.96 26.0 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 -177.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.7 t -114.36 -173.29 2.26 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.443 0.639 . . . . 0.0 110.237 -178.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.425 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -123.95 102.95 8.04 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 177.557 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.517 ' HB3' HD13 ' A' ' 41' ' ' ILE . 25.1 mt -63.15 88.75 0.03 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.367 -1.458 . . . . 0.0 110.617 -176.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.539 ' H ' ' HE3' ' A' ' 74' ' ' LYS . 3.1 pp -120.78 10.1 10.86 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.539 ' HE3' ' H ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -72.22 38.62 0.07 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.134 -0.979 . . . . 0.0 110.846 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.509 ' HB ' ' H ' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -55.65 -6.84 0.22 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.287 -1.508 . . . . 0.0 108.704 179.477 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 76' ' ' HIS . . . . . 0.498 ' H ' ' C ' ' A' ' 74' ' ' LYS . 16.1 t60 -59.86 -77.05 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 110.035 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -82.34 -118.7 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.098 -1.001 . . . . 0.0 109.647 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.531 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -153.75 150.56 28.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.642 -1.286 . . . . 0.0 109.757 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.66 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -43.86 -47.6 8.25 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.064 -1.022 . . . . 0.0 110.021 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.444 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 7.2 t70 -47.38 -34.17 6.72 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.312 -0.867 . . . . 0.0 109.518 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.1 -30.34 70.33 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -179.44 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 79' ' ' LEU . 1.1 t80 -81.37 -49.62 10.46 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 122.82 9.4 6.29 Favored Glycine 0 N--CA 1.512 3.754 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 47.0 mt -60.87 161.73 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 O-C-N 122.075 -0.662 . . . . 0.0 109.242 179.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -164.39 -168.28 1.49 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.91 . . . . 0.0 109.438 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.64 -26.55 67.12 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.294 -0.879 . . . . 0.0 109.896 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -76.79 -10.09 59.13 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.13 112.32 24.13 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.4 mmtp -97.54 117.29 31.49 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.944 -1.098 . . . . 0.0 109.837 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.487 ' HG ' HD12 ' A' ' 20' ' ' LEU . 5.2 mt -95.64 175.62 6.47 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.41 ' NE2' ' CH2' ' A' ' 64' ' ' TRP . 8.1 mt-30 -134.08 161.56 34.51 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 3.4 t80 -122.94 125.62 45.66 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.498 1.964 0 O-C-N 121.36 -0.837 . . . . 0.0 108.866 -179.219 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 547' ' ' SER . . . . . 0.556 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.4 mp -58.93 135.84 57.7 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.77 -1.206 . . . . 0.0 110.828 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 549' ' ' CYS . . . . . 0.503 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.14 104.13 13.93 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 178.073 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.2 t -51.77 127.06 19.68 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 122.137 0.97 . . . . 0.0 109.599 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.84 -33.24 6.15 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 106.199 -2.76 . . . . 0.0 106.199 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.4 m -107.65 -35.94 6.57 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.58 56.38 6.29 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 122.61 1.195 . . . . 0.0 110.038 -178.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -140.62 124.08 10.24 Favored Pre-proline 0 C--N 1.293 -1.863 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -44.05 136.02 7.84 Favored 'Trans proline' 0 N--CA 1.494 1.526 0 CA-C-N 120.441 1.193 . . . . 0.0 115.113 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 556' ' ' ILE . . . . . 0.556 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.7 mt -95.35 97.97 7.37 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 557' ' ' THR . . . . . 0.423 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.2 p -100.07 91.37 4.75 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.227 -0.92 . . . . 0.0 111.279 -177.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.3 -95.18 0.15 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 107.532 -2.227 . . . . 0.0 107.532 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 559' ' ' ARG . . . . . 0.482 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.0 mmt-85 -114.04 152.71 30.59 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.047 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 18.6 p -144.63 126.25 15.09 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.947 -1.096 . . . . 0.0 111.605 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -90.74 146.48 6.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 562' ' ' THR . . . . . 0.759 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.1 m -118.2 147.29 43.53 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 121.834 0.826 . . . . 0.0 109.226 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 563' ' ' ALA . . . . . 0.747 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.94 -129.08 0.25 Allowed 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.563 0.697 . . . . 0.0 109.495 -178.667 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 564' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.7 mtp -65.66 26.3 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 565' ' ' ALA . . . . . 0.747 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.95 -9.07 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.3 163.14 23.14 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 567' ' ' LYS . . . . . 0.508 ' O ' ' CD1' ' B' ' 568' ' ' PHE . 18.6 mmmt -104.8 174.56 5.83 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 568' ' ' PHE . . . . . 0.508 ' CD1' ' O ' ' B' ' 567' ' ' LYS . 2.9 m-85 -159.81 132.01 6.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.526 -1.359 . . . . 0.0 110.219 -178.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 569' ' ' HIS . . . . . 0.576 ' ND1' ' ND1' ' B' ' 572' ' ' HIS . 9.0 m80 -53.3 113.4 4.68 Favored Pre-proline 0 C--N 1.305 -1.347 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 176.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 570' ' ' PRO . . . . . 0.453 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 31.2 Cg_exo -47.66 -13.26 0.17 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 CA-C-N 120.426 1.188 . . . . 0.0 110.802 -178.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 571' ' ' GLU . . . . . 0.867 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.9 mt-10 -92.22 -52.19 4.81 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 122.079 0.943 . . . . 0.0 110.359 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 572' ' ' HIS . . . . . 0.576 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -59.93 -5.67 1.06 Allowed 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.086 -1.009 . . . . 0.0 110.046 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 573' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -127.72 56.01 1.6 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 574' ' ' VAL . . . . . 0.867 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.2 m -94.85 177.27 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.765 0.793 . . . . 0.0 111.448 -178.3 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 575' ' ' CYS . . . . . 0.599 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.63 143.02 32.22 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 178.599 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.12 73.12 6.33 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 116.065 -2.254 . . . . 0.0 108.703 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 577' ' ' PHE . . . . . 0.416 ' O ' ' N ' ' A' ' 59' ' ' SER . 0.4 OUTLIER -157.52 -36.95 0.07 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 173.883 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 578' ' ' CYS . . . . . 0.584 ' O ' ' N ' ' B' ' 580' ' ' LYS . 29.8 p -137.12 82.43 1.93 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 178.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 579' ' ' LEU . . . . . 0.849 HD13 ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.46 13.96 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -176.493 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 580' ' ' LYS . . . . . 0.584 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -96.05 -38.3 10.26 Favored 'General case' 0 N--CA 1.505 2.323 0 CA-C-N 121.369 1.895 . . . . 0.0 113.024 -178.73 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 581' ' ' GLN . . . . . 0.453 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.1 tp-100 -160.64 140.2 10.85 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 119.47 -2.019 . . . . 0.0 115.652 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 582' ' ' LEU . . . . . 0.599 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.2 tp -135.07 170.1 16.42 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.155 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 583' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' B' ' 587' ' ' PHE . 79.2 m-20 -144.8 129.23 17.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.051 -1.031 . . . . 0.0 109.261 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 584' ' ' LYS . . . . . 0.759 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 0.3 OUTLIER -53.85 -16.17 1.66 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.418 -0.801 . . . . 0.0 109.514 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.88 -17.76 53.07 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.8 p -135.63 28.94 3.26 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 587' ' ' PHE . . . . . 0.573 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 1.1 p90 -88.93 106.1 18.19 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 122.762 1.268 . . . . 0.0 109.738 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 588' ' ' LYS . . . . . 0.53 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.05 167.66 10.75 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 589' ' ' GLU . . . . . 0.445 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.7 tt0 -152.07 156.96 40.95 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 122.679 1.228 . . . . 0.0 110.593 -179.058 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 590' ' ' GLN . . . . . 0.498 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 1.8 tp60 -158.59 146.47 18.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 591' ' ' ASN . . . . . 0.476 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 47.1 22.37 0.22 Allowed 'General case' 0 C--N 1.296 -1.746 0 O-C-N 121.008 -1.057 . . . . 0.0 109.906 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 81.07 -3.96 1.72 Allowed 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.664 -0.648 . . . . 0.0 111.149 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -89.6 123.57 66.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 O-C-N 121.116 -0.99 . . . . 0.0 109.125 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 594' ' ' PRO . . . . . 0.494 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 45.8 Cg_exo -48.26 165.44 0.15 Allowed 'Trans proline' 0 N--CA 1.485 1.026 0 CA-C-N 120.301 1.143 . . . . 0.0 110.923 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 595' ' ' TYR . . . . . 0.53 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.1 m-85 -170.3 141.1 1.97 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.734 -1.229 . . . . 0.0 111.204 -178.384 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 26.4 m -78.63 154.2 30.44 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 104.627 -2.36 . . . . 0.0 104.627 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -61.44 -56.5 19.47 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 598' ' ' ASN . . . . . 0.59 ' HA ' HD22 ' B' ' 601' ' ' LEU . 1.4 m120 -44.97 -33.85 2.19 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.63 0.729 . . . . 0.0 109.741 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 68.0 m -78.66 -62.85 1.56 Allowed 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.419 -0.801 . . . . 0.0 110.015 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 600' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -57.78 -47.57 82.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 122.102 -0.374 . . . . 0.0 111.937 -178.17 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 601' ' ' LEU . . . . . 0.98 HD23 ' H ' ' B' ' 602' ' ' LYS . 0.0 OUTLIER -56.28 -51.4 68.31 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 120.721 -1.237 . . . . 0.0 108.438 -177.892 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 602' ' ' LYS . . . . . 0.98 ' H ' HD23 ' B' ' 601' ' ' LEU . 18.5 tttt -45.56 -24.93 0.38 Allowed 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.389 -0.82 . . . . 0.0 109.972 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 603' ' ' LEU . . . . . 0.452 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.3 OUTLIER -95.91 -57.03 2.47 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.078 -1.014 . . . . 0.0 111.161 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 604' ' ' PHE . . . . . 0.501 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 37.8 m-85 -97.92 22.42 9.29 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.153 -0.967 . . . . 0.0 110.336 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 605' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 58.2 m . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.343 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.4 mmt . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 122.164 0.983 . . . . 0.0 109.692 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.89 -49.81 0.07 Allowed 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.273 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.584 ' C ' ' H ' ' A' ' 5' ' ' GLY . 54.6 mt -42.77 -77.68 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 122.025 0.917 . . . . 0.0 109.751 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.592 ' OD2' HD11 ' A' ' 6' ' ' ILE . 7.4 t0 61.29 -7.04 0.1 Allowed 'General case' 0 C--N 1.296 -1.718 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.801 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.584 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 116.73 -12.89 15.16 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.348 -1.901 . . . . 0.0 108.348 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.668 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -114.45 -103.83 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -179.157 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.56 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -156.49 -99.26 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.275 0 O-C-N 120.546 -1.346 . . . . 0.0 109.949 -179.404 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.56 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -144.66 -62.46 0.02 OUTLIER Pre-proline 0 N--CA 1.502 2.135 0 O-C-N 120.981 -1.074 . . . . 0.0 110.717 -179.248 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -43.1 -32.4 2.9 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 CA-C-N 121.238 1.478 . . . . 0.0 109.89 178.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -117.68 -25.02 7.01 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 114.637 -1.165 . . . . 0.0 107.95 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.09 13.82 65.2 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 8' ' ' MET . 12.6 t -164.36 -67.85 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.55 -0.971 . . . . 0.0 109.735 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.667 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 3.5 t80 80.66 -46.84 0.27 Allowed 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 -178.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.667 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 157.47 -35.96 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -166.95 3.45 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.228 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.68 30.07 41.05 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.575 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -96.16 125.66 40.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.273 -1.134 . . . . 0.0 109.999 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.502 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -128.97 120.97 27.03 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 178.18 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.619 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.86 127.74 33.91 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.963 -1.086 . . . . 0.0 109.02 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.477 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.95 134.59 34.65 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -77.98 145.4 36.04 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.487 -0.885 . . . . 0.0 108.981 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.84 104.06 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-O 121.829 0.823 . . . . 0.0 109.909 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -79.66 104.5 10.3 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.587 HG13 ' CD2' ' A' ' 92' ' ' PHE . 3.6 t -74.76 118.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.047 -1.461 . . . . 0.0 109.114 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.3 p -85.32 -25.96 26.85 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.411 -0.806 . . . . 0.0 109.39 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -78.04 -8.16 57.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 108.702 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mt -130.3 -22.64 2.77 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' VAL . 31.3 t-20 75.47 12.56 3.16 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.427 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 74.9 mtp180 -95.32 -178.62 4.5 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.161 -0.962 . . . . 0.0 109.661 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 29' ' ' ARG . 72.4 m-20 -136.16 113.93 11.12 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 t -113.87 157.54 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-O 121.342 0.592 . . . . 0.0 109.489 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.446 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -128.51 135.99 50.18 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 32' ' ' THR . 3.1 mm? -115.34 113.55 23.95 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.777 -0.577 . . . . 0.0 109.743 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.575 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 9.0 tpt180 -60.25 105.6 0.43 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.9 m -134.18 -169.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.908 0.861 . . . . 0.0 110.591 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p -140.44 172.42 12.75 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.502 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -79.94 46.48 3.15 Favored Glycine 0 N--CA 1.485 1.903 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.442 ' C ' HG21 ' A' ' 78' ' ' THR . 4.9 pt-20 -149.75 4.31 0.57 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.675 -0.897 . . . . 0.0 108.928 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 78' ' ' THR . 3.1 m -87.02 137.29 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.945 -1.097 . . . . 0.0 109.959 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.463 ' O ' ' N ' ' A' ' 43' ' ' GLY . 4.2 m80 -79.73 147.83 31.76 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.042 -1.037 . . . . 0.0 108.656 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.442 ' C ' ' N ' ' A' ' 43' ' ' GLY . 59.5 mt -48.46 -52.56 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.126 -0.984 . . . . 0.0 109.381 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.64 -15.24 4.28 Favored Glycine 0 N--CA 1.484 1.857 0 N-CA-C 108.107 -1.997 . . . . 0.0 108.107 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -81.43 -28.32 44.4 Favored Glycine 0 N--CA 1.481 1.698 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.401 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.16 -55.29 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -1.126 . . . . 0.0 109.487 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -37.2 30.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.715 -1.24 . . . . 0.0 108.859 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.472 HD13 HD13 ' B' ' 603' ' ' LEU . 5.5 tp -57.52 -65.57 0.61 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.204 -0.935 . . . . 0.0 109.412 179.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -51.42 -59.46 4.21 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.409 -0.807 . . . . 0.0 111.523 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.919 HD23 ' HE2' ' A' ' 61' ' ' HIS . 25.1 tp -45.78 -46.07 15.08 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.091 -1.006 . . . . 0.0 109.83 -178.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.49 ' O ' ' N ' ' A' ' 52' ' ' LEU . 11.6 t -67.21 -48.38 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.032 -1.043 . . . . 0.0 108.826 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -45.04 -40.42 6.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.354 -0.841 . . . . 0.0 109.683 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -66.74 -31.9 72.86 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.349 -0.844 . . . . 0.0 108.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 49' ' ' VAL . 3.7 tp -67.7 -66.55 0.55 Allowed 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 t70 64.42 75.89 0.36 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.747 0.784 . . . . 0.0 110.051 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.545 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.5 p -173.07 152.55 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 C-N-CA 120.186 -0.605 . . . . 0.0 109.799 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -71.01 37.52 0.05 Allowed 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' ' 54' ' ' VAL . 19.2 tttp -77.97 179.97 6.44 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.082 -1.011 . . . . 0.0 109.237 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.521 ' N ' ' OD2' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -60.13 92.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.312 -0.867 . . . . 0.0 110.223 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.454 ' CE2' HG13 ' A' ' 49' ' ' VAL . 16.4 m0 -91.07 -35.98 14.29 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.253 -0.904 . . . . 0.0 109.511 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.559 ' C ' ' H ' ' A' ' 61' ' ' HIS . 3.7 t -73.99 -34.37 64.18 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.967 -1.083 . . . . 0.0 108.838 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -71.88 19.27 0.07 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.919 ' HE2' HD23 ' A' ' 48' ' ' LEU . 5.7 t-80 -105.65 130.43 53.68 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 122.024 0.916 . . . . 0.0 111.864 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 93' ' ' THR . . . -170.02 145.19 2.84 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.797 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.1 mm? -94.93 143.03 26.8 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.771 -1.206 . . . . 0.0 110.363 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.522 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.73 150.03 49.97 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.31 93.61 4.6 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.029 -1.044 . . . . 0.0 108.725 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -55.21 -23.73 23.73 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 111.058 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.528 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.2 mmtp -69.23 -8.89 49.99 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 178.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.6 mmtt -133.32 -12.43 2.77 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.731 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.39 46.21 27.09 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -178.148 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -112.43 -172.93 2.14 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.362 0.601 . . . . 0.0 109.868 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.557 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.04 98.66 5.2 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 177.424 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.402 ' HB3' HD13 ' A' ' 41' ' ' ILE . 29.0 mt -60.34 91.01 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 122.618 1.199 . . . . 0.0 109.984 -177.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 71' ' ' TRP . 1.9 pp -123.64 14.55 9.44 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.605 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -90.44 72.36 6.98 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.275 -0.891 . . . . 0.0 109.332 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.529 HG21 ' O ' ' B' ' 602' ' ' LYS . 3.1 m -62.38 -13.67 31.9 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.978 -1.076 . . . . 0.0 110.002 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.69 -50.91 15.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.102 -0.999 . . . . 0.0 109.767 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -172.14 1.65 Allowed 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.712 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -137.73 -164.92 1.69 Allowed 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.626 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.572 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.0 mp -69.72 -59.63 2.83 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -46.91 -51.99 15.53 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.137 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.712 ' CG ' ' H ' ' A' ' 78' ' ' THR . 33.8 mmtt -44.91 -55.01 5.84 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.542 0.687 . . . . 0.0 109.966 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.23 -40.22 59.25 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.136 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.88 7.01 8.91 Favored Glycine 0 N--CA 1.5 2.95 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.499 HG22 ' N ' ' A' ' 85' ' ' GLN . 52.8 mt -62.0 160.86 2.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.45 -1.029 . . . . 0.0 109.386 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.499 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.7 tp60 -171.92 -163.47 0.26 Allowed 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.1 62.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.88 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -75.12 -9.93 59.0 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.68 113.64 26.22 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -94.46 116.53 28.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.985 -1.072 . . . . 0.0 109.524 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.443 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.1 mt -94.81 176.79 6.13 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.444 0.64 . . . . 0.0 109.296 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.522 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.8 mt-30 -132.35 159.25 39.74 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -115.89 94.2 4.58 Favored 'General case' 0 N--CA 1.503 2.183 0 CA-C-O 122.484 1.135 . . . . 0.0 108.023 179.237 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.439 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -146.67 161.07 39.33 Favored Pre-proline 0 N--CA 1.492 1.675 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.493 1.482 0 C-N-CA 122.311 2.007 . . . . 0.0 111.737 179.813 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 541' ' ' TYR . . . . . 0.421 ' O ' ' O ' ' B' ' 542' ' ' HIS . 7.0 p90 . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 542' ' ' HIS . . . . . 0.516 ' ND1' ' N ' ' B' ' 542' ' ' HIS . 1.4 m-70 -57.78 -162.35 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.239 -0.913 . . . . 0.0 109.524 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -139.7 -4.53 1.4 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.329 -0.857 . . . . 0.0 109.757 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.512 ' HG2' HH21 ' B' ' 544' ' ' ARG . 0.7 OUTLIER -65.73 103.06 0.82 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.056 -1.027 . . . . 0.0 109.639 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.514 ' NH1' ' O ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -94.09 -153.31 0.37 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.26 -0.9 . . . . 0.0 108.72 179.875 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 546' ' ' GLY . . . . . 0.514 ' O ' ' NH1' ' B' ' 545' ' ' ARG . . . -170.15 -98.72 0.12 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.542 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -167.34 118.74 0.89 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.281 -1.129 . . . . 0.0 108.161 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.25 135.75 57.82 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 120.855 -1.153 . . . . 0.0 110.315 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.479 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.81 103.9 13.46 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.317 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.5 t -51.21 127.05 18.34 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 122.191 0.996 . . . . 0.0 109.59 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.67 -34.59 5.39 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 106.161 -2.776 . . . . 0.0 106.161 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.85 -35.57 7.29 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.02 56.37 6.67 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.699 1.237 . . . . 0.0 109.957 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -140.64 123.78 10.06 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -44.21 135.38 8.54 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 CA-C-N 120.489 1.21 . . . . 0.0 114.604 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.1 mt -93.4 98.34 8.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 557' ' ' THR . . . . . 0.424 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.3 p -99.38 91.57 5.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.246 -0.909 . . . . 0.0 111.223 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.6 -95.26 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.481 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -114.76 152.33 32.26 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 177.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.6 126.53 15.4 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.932 -1.105 . . . . 0.0 111.541 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.9 mt -91.01 146.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 7.9 m -118.48 146.94 44.11 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-O 121.79 0.805 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.53 -129.39 0.26 Allowed 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.604 0.716 . . . . 0.0 109.331 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.554 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.3 mtt -65.78 26.34 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.01 -8.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.73 161.0 23.5 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.73 174.29 5.94 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -160.2 136.34 8.64 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.233 -1.387 . . . . 0.0 109.861 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.572 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.61 114.99 8.3 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.442 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 47.1 Cg_exo -45.69 -12.44 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 CA-C-N 120.316 1.148 . . . . 0.0 111.449 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.857 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.9 mt-10 -96.51 -52.73 3.84 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 122.001 0.905 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.439 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 19.1 m170 -57.61 -4.29 0.25 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.897 -1.127 . . . . 0.0 109.886 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.444 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.7 t80 -127.34 55.04 1.62 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.857 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.48 177.73 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.802 0.81 . . . . 0.0 111.116 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.638 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.19 143.42 29.63 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.408 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 576' ' ' ALA . . . . . 0.453 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -92.98 75.56 4.76 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 116.769 -1.972 . . . . 0.0 109.589 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -153.29 -54.51 0.11 Allowed 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 102.599 -3.112 . . . . 0.0 102.599 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.529 ' O ' ' N ' ' B' ' 580' ' ' LYS . 23.8 p -127.57 78.89 1.85 Allowed 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 111.567 -2.561 . . . . 0.0 104.253 177.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.5 mt -53.14 15.55 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.84 -37.13 18.03 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 119.735 -1.853 . . . . 0.0 112.122 -178.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.433 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.3 tp-100 -159.65 140.89 12.69 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 119.636 -1.915 . . . . 0.0 114.466 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.638 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.0 tp -136.34 170.68 15.64 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.434 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.2 m-20 -144.94 128.47 17.03 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.277 -0.89 . . . . 0.0 109.143 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -15.99 0.8 Allowed 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.43 -0.794 . . . . 0.0 109.625 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.17 -21.05 50.98 Favored Glycine 0 N--CA 1.485 1.91 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -133.73 28.91 3.89 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.576 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.7 OUTLIER -89.94 108.98 20.04 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.489 1.137 . . . . 0.0 110.115 -179.692 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.5 160.0 14.81 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.8 tt0 -154.82 157.0 37.24 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 122.584 1.183 . . . . 0.0 111.115 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.435 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 21.3 pt20 -156.65 146.04 20.57 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 177.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.534 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.88 23.8 0.74 Allowed 'General case' 0 C--N 1.289 -2.048 0 O-C-N 121.29 -0.881 . . . . 0.0 109.465 -178.656 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.6 m-20 82.93 -7.06 1.23 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.791 -0.568 . . . . 0.0 111.661 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.7 mttm -86.01 116.22 64.87 Favored Pre-proline 0 C--N 1.293 -1.867 0 O-C-N 121.042 -1.036 . . . . 0.0 110.723 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.471 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.4 Cg_exo -52.57 162.84 2.09 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 CA-C-N 119.919 1.007 . . . . 0.0 112.328 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.471 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 20.1 m-85 -171.27 143.63 1.9 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.247 -0.908 . . . . 0.0 110.289 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.4 m -75.29 153.87 37.7 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 173.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -56.97 -57.13 13.87 Favored 'General case' 0 C--N 1.289 -2.036 0 C-N-CA 117.475 -1.69 . . . . 0.0 106.813 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.27 -28.77 1.38 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.48 -0.763 . . . . 0.0 109.6 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 80.1 m -82.76 -61.08 1.97 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.312 -0.867 . . . . 0.0 109.039 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.45 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 1.1 t80 -55.45 -55.33 32.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.535 -0.728 . . . . 0.0 109.582 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.689 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.21 -42.83 31.16 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.209 -0.932 . . . . 0.0 109.14 -178.939 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.529 ' O ' HG21 ' A' ' 75' ' ' THR . 25.7 tptt -56.34 -23.85 40.01 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.215 -0.928 . . . . 0.0 110.002 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.472 HD13 HD13 ' A' ' 46' ' ' LEU . 4.6 mt -89.16 -56.9 3.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.921 -1.112 . . . . 0.0 111.303 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.496 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 16.7 m-85 -109.99 -25.72 10.11 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.262 -0.899 . . . . 0.0 110.59 -178.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.496 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.0 p . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.056 -1.028 . . . . 0.0 109.949 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.6 ttt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.49 -55.72 0.14 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.086 -1.009 . . . . 0.0 108.592 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.428 ' O ' ' N ' ' A' ' 5' ' ' GLY . 74.8 mt -46.0 -84.73 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 122.158 0.98 . . . . 0.0 109.528 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 27.7 t70 45.88 21.86 0.11 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-O 121.846 0.831 . . . . 0.0 109.308 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.428 ' N ' ' O ' ' A' ' 3' ' ' LEU . . . -64.49 -14.49 57.51 Favored Glycine 0 N--CA 1.486 2.03 0 N-CA-C 108.07 -2.012 . . . . 0.0 108.07 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.698 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -108.72 -99.66 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -179.143 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.551 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -153.03 -98.43 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 O-C-N 120.804 -1.185 . . . . 0.0 109.768 -179.568 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.551 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -144.78 -62.61 0.02 OUTLIER Pre-proline 0 N--CA 1.501 2.08 0 O-C-N 120.98 -1.075 . . . . 0.0 110.572 -179.275 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' O ' ' CD1' ' A' ' 13' ' ' TYR . 63.2 Cg_exo -44.45 -34.64 7.77 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 CA-C-N 121.16 1.45 . . . . 0.0 109.975 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -113.07 -25.7 8.82 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.166 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.76 8.65 78.89 Favored Glycine 0 N--CA 1.487 2.091 0 N-CA-C 109.412 -1.475 . . . . 0.0 109.412 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 8' ' ' MET . 12.8 t -164.17 -35.19 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.217 -1.166 . . . . 0.0 110.541 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.69 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 43.3 m-85 54.15 -96.37 0.06 Allowed 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 -178.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.69 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 160.35 -36.97 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -161.14 4.85 0.07 Allowed 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.458 -0.776 . . . . 0.0 110.048 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.459 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 73.48 36.69 54.25 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 108.51 -1.836 . . . . 0.0 108.51 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.499 HG23 ' O ' ' A' ' 17' ' ' THR . 6.7 t -90.18 123.23 33.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.57 -0.959 . . . . 0.0 109.907 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.475 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -134.61 123.33 23.63 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.94 130.12 37.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.135 -0.978 . . . . 0.0 109.136 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.46 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.09 134.27 34.61 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.74 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -78.14 145.74 35.5 Favored 'General case' 0 C--N 1.297 -1.694 0 O-C-N 121.296 -0.877 . . . . 0.0 109.77 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 36.7 t -136.73 105.37 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.926 0.87 . . . . 0.0 109.767 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -78.72 104.86 9.62 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.549 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -71.95 100.61 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 O-C-N 121.336 -0.852 . . . . 0.0 110.077 -178.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.556 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -76.07 177.0 7.44 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 178.83 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.9 t70 56.8 6.57 0.31 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.727 -1.233 . . . . 0.0 107.918 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.556 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.8 mt -149.27 -37.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 24' ' ' VAL . 24.8 t-20 77.25 15.97 1.72 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.521 178.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -91.17 -178.97 5.31 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.613 -1.304 . . . . 0.0 108.635 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -140.74 116.93 10.6 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.431 HG12 ' N ' ' A' ' 32' ' ' THR . 23.1 t -119.02 157.43 20.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-O 121.56 0.695 . . . . 0.0 109.792 -178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.501 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.43 134.6 43.81 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.626 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.501 HD22 ' C ' ' A' ' 32' ' ' THR . 3.8 mm? -114.3 114.13 25.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.6 -0.687 . . . . 0.0 109.398 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.471 ' HE ' ' HB3' ' A' ' 19' ' ' GLU . 1.3 tpp85 -57.84 108.52 0.59 Allowed 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.7 m -137.45 -169.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 122.062 0.934 . . . . 0.0 110.352 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -141.81 174.42 10.59 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.475 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -81.48 47.29 3.59 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.419 ' C ' HG21 ' A' ' 78' ' ' THR . 6.0 pt-20 -150.77 4.33 0.49 Allowed 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.737 -0.861 . . . . 0.0 108.994 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.508 ' O ' HG22 ' A' ' 78' ' ' THR . 2.5 m -86.01 143.35 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 120.914 -1.116 . . . . 0.0 109.846 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.503 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -78.56 146.36 34.3 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 179.446 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.465 ' C ' ' N ' ' A' ' 43' ' ' GLY . 97.3 mt -49.57 -56.33 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.053 -1.029 . . . . 0.0 108.828 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.626 ' H ' HG23 ' A' ' 75' ' ' THR . . . -56.45 -9.56 3.47 Favored Glycine 0 N--CA 1.485 1.912 0 N-CA-C 108.089 -2.004 . . . . 0.0 108.089 179.279 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.73 -28.0 66.01 Favored Glycine 0 N--CA 1.484 1.878 0 N-CA-C 107.611 -2.196 . . . . 0.0 107.611 178.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.38 -41.41 16.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 41.5 mtm -48.43 -36.67 15.35 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -71.57 -66.03 0.68 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.391 0.615 . . . . 0.0 110.096 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CB ' HD12 ' A' ' 33' ' ' LEU . 47.0 mttm -53.37 -55.78 22.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.306 -0.871 . . . . 0.0 110.666 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -45.83 -58.45 3.5 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.924 -1.11 . . . . 0.0 109.004 -179.254 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.513 ' O ' ' N ' ' A' ' 52' ' ' LEU . 73.2 t -57.29 -48.26 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.752 -0.592 . . . . 0.0 110.25 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -44.7 -40.04 5.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.081 -1.012 . . . . 0.0 109.512 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.508 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -70.7 -26.37 63.38 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.457 -0.777 . . . . 0.0 109.446 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.6 tp -80.04 -75.05 0.27 Allowed 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.338 -0.851 . . . . 0.0 108.801 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 t70 71.4 83.13 0.14 Allowed 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.835 0.826 . . . . 0.0 110.6 178.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.576 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -170.26 151.84 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.0 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.354 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.46 30.71 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 109.379 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.576 ' H ' ' C ' ' A' ' 54' ' ' VAL . 49.7 tttm -77.73 171.58 14.73 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.011 -1.055 . . . . 0.0 108.413 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.497 ' N ' ' OD1' ' A' ' 57' ' ' ASP . 0.6 OUTLIER -92.67 90.7 7.2 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 120.974 -1.079 . . . . 0.0 109.509 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.448 ' O ' ' O ' ' A' ' 61' ' ' HIS . 2.3 m0 -76.59 -51.56 11.4 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.177 -0.952 . . . . 0.0 108.529 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.8 p -41.51 -56.14 2.63 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.312 0.577 . . . . 0.0 110.406 -178.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.425 ' O ' ' O ' ' A' ' 94' ' ' PRO . 10.5 t0 -52.25 -40.5 61.78 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' O ' ' A' ' 58' ' ' TRP . 16.0 m170 -85.0 123.13 30.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.81 0.814 . . . . 0.0 110.324 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.16 -179.98 5.66 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.836 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.29 143.03 26.74 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.868 -1.145 . . . . 0.0 109.857 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.536 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -130.34 151.7 50.56 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.264 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -110.62 94.55 5.06 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.104 -0.998 . . . . 0.0 108.641 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.418 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 8.5 pt-20 -56.12 -23.55 35.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.245 -0.91 . . . . 0.0 110.813 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.536 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.7 mmtp -68.43 -9.64 49.94 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.1 mmtt -133.1 -12.17 2.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.915 -178.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.67 46.15 27.27 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -178.151 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -113.61 -173.5 2.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.612 0.72 . . . . 0.0 110.126 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.57 102.44 7.37 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.411 ' HB3' HD13 ' A' ' 41' ' ' ILE . 35.6 mt -61.9 86.57 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.325 0 O-C-N 120.504 -1.373 . . . . 0.0 110.548 -176.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.2 pp -120.99 10.88 10.89 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -87.07 36.33 0.73 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.626 HG23 ' H ' ' A' ' 42' ' ' GLY . 21.6 m -46.01 -14.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.223 -0.923 . . . . 0.0 110.058 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 8.4 m80 -62.63 -29.03 70.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.136 -0.977 . . . . 0.0 109.249 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 77.1 m95 -104.17 -155.26 0.53 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.438 -0.789 . . . . 0.0 109.406 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.672 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -144.44 171.29 14.56 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.165 0.983 . . . . 0.0 109.386 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.561 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 7.7 mp -48.11 -62.34 1.52 Allowed 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.127 0.965 . . . . 0.0 108.515 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -45.94 -52.01 12.33 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.874 0.845 . . . . 0.0 110.085 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.672 ' CG ' ' H ' ' A' ' 78' ' ' THR . 31.7 mmtt -45.13 -55.58 5.57 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 121.552 0.691 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.09 -41.86 63.61 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.979 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 121.65 7.08 8.3 Favored Glycine 0 N--CA 1.499 2.89 0 N-CA-C 108.844 -1.703 . . . . 0.0 108.844 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 85' ' ' GLN . 50.5 mt -62.33 161.04 2.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.486 -1.008 . . . . 0.0 109.282 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.485 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.6 tp60 -171.18 -164.63 0.36 Allowed 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.0 -24.29 62.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.403 -0.811 . . . . 0.0 109.694 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 88' ' ' ALA . 28.1 p30 -76.26 -11.46 59.92 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.267 -0.896 . . . . 0.0 108.67 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.456 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.55 113.52 25.97 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -94.46 117.14 29.67 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.106 -0.996 . . . . 0.0 109.773 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.46 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.5 mt -93.84 176.52 6.32 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.466 0.65 . . . . 0.0 109.25 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.536 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.6 mt-30 -133.34 167.73 19.88 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.441 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 25.0 t80 -124.01 99.0 6.04 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.12 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.55 160.09 39.7 Favored Pre-proline 0 N--CA 1.502 2.154 0 O-C-N 121.356 -0.84 . . . . 0.0 111.037 -176.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.425 ' O ' ' O ' ' A' ' 60' ' ' ASP . 43.1 Cg_exo . . . . . 0 N--CA 1.489 1.207 0 C-N-CA 123.574 2.849 . . . . 0.0 112.796 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 6.8 m80 -54.68 -178.72 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.22 -0.925 . . . . 0.0 109.508 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -159.97 2.03 0.08 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.365 -0.835 . . . . 0.0 110.37 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.458 ' HD3' ' H ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER -77.42 -9.63 58.99 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.028 -1.045 . . . . 0.0 109.798 -179.617 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.434 ' HD2' ' H ' ' B' ' 545' ' ' ARG . 0.1 OUTLIER -97.24 -154.66 0.46 Allowed 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 179.639 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . 163.85 -88.42 0.1 Allowed Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.733 -1.222 . . . . 0.0 110.203 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m -169.36 120.01 0.7 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.235 -1.156 . . . . 0.0 108.19 -179.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.06 135.17 57.63 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 120.811 -1.181 . . . . 0.0 110.513 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.49 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.69 104.15 13.57 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.22 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.1 t -51.46 127.19 19.32 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.24 1.019 . . . . 0.0 109.674 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.7 -34.54 5.41 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 10.8 m -105.75 -35.97 7.2 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.3 56.4 6.44 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.682 1.23 . . . . 0.0 109.997 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -140.79 124.08 10.07 Favored Pre-proline 0 C--N 1.294 -1.815 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -44.14 135.15 8.45 Favored 'Trans proline' 0 N--CA 1.491 1.376 0 CA-C-N 120.433 1.19 . . . . 0.0 114.842 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.0 mt -93.83 98.41 8.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.2 p -98.97 91.34 4.99 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.191 -0.943 . . . . 0.0 111.349 -177.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.0 -96.76 0.16 Allowed Glycine 0 N--CA 1.487 2.07 0 N-CA-C 107.579 -2.209 . . . . 0.0 107.579 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.486 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.2 mmt-85 -111.77 151.95 28.4 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 23.7 p -144.57 126.45 15.35 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.902 -1.124 . . . . 0.0 111.512 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 44.8 mt -90.75 146.06 6.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.466 ' H ' ' HD2' ' B' ' 584' ' ' LYS . 8.8 m -118.8 146.53 44.75 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.847 0.832 . . . . 0.0 109.009 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.739 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -129.29 0.26 Allowed 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.598 0.713 . . . . 0.0 109.287 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 3.1 mtt -66.29 26.69 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.739 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.27 -9.06 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.63 159.41 24.03 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 567' ' ' LYS . . . . . 0.404 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 16.9 mmmt -102.55 174.67 5.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 568' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 2.5 m-85 -160.29 132.85 6.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.236 -1.386 . . . . 0.0 110.225 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.532 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.6 m80 -53.88 113.81 5.51 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.447 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.88 -12.53 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.535 0 CA-C-N 120.458 1.199 . . . . 0.0 110.731 -178.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.877 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.5 mt-10 -91.86 -51.81 5.04 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 122.076 0.941 . . . . 0.0 110.243 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.481 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -61.48 -3.22 0.92 Allowed 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.168 -0.957 . . . . 0.0 109.896 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.409 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.1 t80 -132.19 59.21 1.72 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.877 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.9 m -94.59 177.76 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.931 0.872 . . . . 0.0 111.518 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.666 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.92 145.52 27.73 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.505 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.64 76.22 3.26 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 116.843 -1.943 . . . . 0.0 109.844 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -152.68 -52.48 0.11 Allowed 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 102.191 -3.263 . . . . 0.0 102.191 173.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.0 p -129.63 80.11 1.94 Allowed 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 111.437 -2.62 . . . . 0.0 104.47 176.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mt -52.43 16.11 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.836 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.52 -36.87 17.37 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 119.632 -1.917 . . . . 0.0 112.551 -178.673 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.447 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -159.05 140.14 12.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 119.611 -1.93 . . . . 0.0 114.653 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.666 HD13 ' HB2' ' B' ' 575' ' ' CYS . 22.2 tp -137.11 169.54 17.6 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.144 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.1 m-20 -147.09 131.24 17.35 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.313 -0.867 . . . . 0.0 109.229 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.466 ' HD2' ' H ' ' B' ' 562' ' ' THR . 14.6 ptmt -52.58 -21.89 4.37 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.443 -0.785 . . . . 0.0 109.476 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.64 -17.31 64.13 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -179.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.64 26.95 3.38 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.82 108.51 19.74 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 122.729 1.252 . . . . 0.0 110.06 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.531 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.99 167.88 9.55 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.424 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.5 tt0 -153.15 156.3 38.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.808 -1.183 . . . . 0.0 110.373 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.424 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 7.8 tt0 -157.96 146.68 19.21 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 178.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.519 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 50.08 21.99 0.84 Allowed 'General case' 0 C--N 1.29 -1.997 0 O-C-N 121.182 -0.949 . . . . 0.0 109.26 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.1 m-20 81.2 -4.99 1.66 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.786 -0.571 . . . . 0.0 110.716 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 593' ' ' LYS . . . . . 0.412 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 33.4 mttm -91.36 118.98 68.77 Favored Pre-proline 0 C--N 1.295 -1.795 0 O-C-N 121.258 -0.901 . . . . 0.0 109.575 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.0 Cg_exo -49.23 166.44 0.18 Allowed 'Trans proline' 0 N--CA 1.488 1.171 0 CA-C-N 120.135 1.084 . . . . 0.0 111.494 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' B' ' 588' ' ' LYS . 21.9 m-85 -170.55 137.3 1.36 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.08 -1.012 . . . . 0.0 110.756 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 16.3 m -69.55 154.28 42.23 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 173.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -58.81 -56.68 19.04 Favored 'General case' 0 C--N 1.289 -2.046 0 C-N-CA 117.479 -1.689 . . . . 0.0 106.459 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -45.53 -26.53 0.6 Allowed 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.587 -0.696 . . . . 0.0 109.845 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 93.4 m -84.48 -65.4 1.01 Allowed 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.155 -0.965 . . . . 0.0 109.31 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 600' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -51.27 -56.66 11.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.497 -0.752 . . . . 0.0 109.38 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.688 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.31 -42.47 31.12 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.262 -0.898 . . . . 0.0 109.064 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.405 ' O ' HG21 ' A' ' 75' ' ' THR . 24.1 tptp -58.8 -20.27 48.64 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.366 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.87 -56.44 3.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.751 -1.218 . . . . 0.0 110.779 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.41 ' O ' ' C ' ' B' ' 605' ' ' CYS . 9.5 m-85 -107.43 32.35 4.74 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.414 -0.804 . . . . 0.0 109.924 -178.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.41 ' C ' ' O ' ' B' ' 604' ' ' PHE . 9.4 t . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.924 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.643 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.643 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -150.93 -42.31 0.12 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.825 -1.172 . . . . 0.0 108.74 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.896 ' H ' HD12 ' A' ' 3' ' ' LEU . 5.8 mp -55.86 -66.49 0.41 Allowed 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 122.206 1.003 . . . . 0.0 109.242 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.409 ' C ' ' N ' ' A' ' 6' ' ' ILE . 22.9 t70 -73.87 14.37 0.4 Allowed 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.051 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.551 ' C ' HD13 ' A' ' 6' ' ' ILE . . . -60.93 -13.74 34.95 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 107.402 -2.279 . . . . 0.0 107.402 179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.772 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -116.13 -95.37 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.571 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -153.03 -98.67 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.181 -0.949 . . . . 0.0 109.758 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.605 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -146.32 -64.49 0.02 OUTLIER Pre-proline 0 N--CA 1.499 1.99 0 O-C-N 121.022 -1.049 . . . . 0.0 110.575 -179.192 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo -46.37 -28.54 6.03 Favored 'Trans proline' 0 N--CA 1.494 1.513 0 CA-C-N 121.756 1.663 . . . . 0.0 109.946 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -115.79 -26.41 7.4 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -93.6 9.06 74.2 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.605 ' N ' ' O ' ' A' ' 8' ' ' MET . 39.4 t -157.71 -102.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.585 -0.95 . . . . 0.0 109.387 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.568 ' CG ' ' O ' ' A' ' 12' ' ' CYS . 26.3 m-85 -169.25 -104.15 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.358 -0.839 . . . . 0.0 108.872 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -179.06 -41.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -142.6 2.62 1.42 Allowed 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.22 21.71 69.72 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 108.804 -1.718 . . . . 0.0 108.804 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -95.7 122.53 38.56 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.471 -1.017 . . . . 0.0 109.802 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.609 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -131.27 120.93 23.89 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.26 129.37 35.81 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.162 -0.961 . . . . 0.0 109.215 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.474 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.79 134.42 34.73 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.183 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.22 146.24 35.05 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.272 -0.893 . . . . 0.0 109.794 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -138.51 105.44 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 CA-C-O 121.786 0.803 . . . . 0.0 110.059 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.494 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 2.8 m80 -79.59 104.75 10.41 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -71.11 98.21 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.258 -0.901 . . . . 0.0 109.915 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.502 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -70.03 164.28 24.34 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.9 t70 72.09 -43.65 0.57 Allowed 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 25' ' ' THR . 4.8 mt -93.25 -30.77 15.01 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.565 ' N ' ' O ' ' A' ' 24' ' ' VAL . 27.7 t-20 73.31 17.45 3.93 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.085 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtp85 -94.27 -178.73 4.7 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.899 -1.126 . . . . 0.0 109.142 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.494 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 9.9 m-20 -140.18 117.8 11.57 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG12 ' N ' ' A' ' 32' ' ' THR . 20.1 t -120.7 157.76 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.653 0.739 . . . . 0.0 110.013 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.463 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.06 135.36 45.3 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.463 HD22 ' C ' ' A' ' 32' ' ' THR . 3.7 mm? -113.53 111.59 22.15 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.511 -0.743 . . . . 0.0 109.322 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -61.11 102.45 0.21 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.9 m -129.95 -169.16 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 CA-C-O 121.936 0.874 . . . . 0.0 109.969 -178.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.7 p -139.32 169.59 17.49 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.609 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -77.13 44.66 2.17 Favored Glycine 0 N--CA 1.485 1.943 0 C-N-CA 119.386 -1.387 . . . . 0.0 109.634 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.486 ' C ' HG21 ' A' ' 78' ' ' THR . 3.9 pt-20 -146.61 4.04 0.87 Allowed 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.608 -0.936 . . . . 0.0 108.795 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -88.17 137.19 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.67 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.8 m80 -76.1 146.78 39.08 Favored 'General case' 0 C--N 1.293 -1.865 0 O-C-N 120.942 -1.099 . . . . 0.0 108.689 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.409 ' C ' ' N ' ' A' ' 43' ' ' GLY . 97.7 mt -45.93 -58.64 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.964 . . . . 0.0 109.583 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.506 ' H ' HG22 ' A' ' 75' ' ' THR . . . -54.8 -16.82 8.08 Favored Glycine 0 C--N 1.297 -1.602 0 N-CA-C 108.496 -1.841 . . . . 0.0 108.496 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -69.34 -29.17 71.94 Favored Glycine 0 N--CA 1.483 1.772 0 N-CA-C 107.941 -2.063 . . . . 0.0 107.941 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 t -84.79 -39.81 14.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.49 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.0 mtm -46.68 -37.67 8.68 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.764 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -78.22 -56.94 4.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.711 -0.618 . . . . 0.0 110.641 -178.514 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -53.03 -59.85 4.03 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.794 -1.191 . . . . 0.0 110.738 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.68 -44.92 13.84 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.153 -0.967 . . . . 0.0 109.364 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.423 HG13 ' CE2' ' A' ' 58' ' ' TRP . 39.9 t -68.27 -48.01 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.514 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -45.08 -39.24 5.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 0.0 109.866 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.54 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 8.7 mtmp? -75.93 -28.38 57.98 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.347 -0.846 . . . . 0.0 110.447 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.416 HD23 ' HE1' ' A' ' 58' ' ' TRP . 11.1 tp -60.99 -65.93 0.61 Allowed 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.084 -1.01 . . . . 0.0 108.878 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.2 t70 75.53 77.95 0.1 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.909 0.862 . . . . 0.0 110.422 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.557 ' O ' ' N ' ' A' ' 56' ' ' LYS . 3.0 p -175.05 126.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.007 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.477 ' HG3' HD12 ' B' ' 579' ' ' LEU . 18.1 tptt -65.0 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 109.873 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.557 ' N ' ' O ' ' A' ' 54' ' ' VAL . 4.5 ttpm? -77.66 161.23 27.94 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.041 -1.037 . . . . 0.0 108.701 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.418 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -66.71 93.37 0.25 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.296 -0.877 . . . . 0.0 109.38 -179.557 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.528 ' CZ2' ' O ' ' A' ' 54' ' ' VAL . 16.7 m0 -83.77 -46.49 12.17 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.839 0.828 . . . . 0.0 109.029 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.8 m -42.69 -55.19 3.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.299 -0.876 . . . . 0.0 110.47 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.42 ' OD1' ' O ' ' A' ' 94' ' ' PRO . 12.5 t0 -50.5 -23.35 2.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.407 -0.808 . . . . 0.0 110.215 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.467 ' CB ' ' CZ ' ' A' ' 92' ' ' PHE . 21.9 m-70 -90.89 160.05 15.9 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.998 -1.064 . . . . 0.0 111.864 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.26 170.56 13.07 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.812 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -94.36 146.23 24.2 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.6 -1.313 . . . . 0.0 110.07 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.577 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -129.86 151.57 50.29 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.07 93.77 4.65 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.108 -0.995 . . . . 0.0 108.782 -179.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -55.48 -23.83 27.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.29 -0.881 . . . . 0.0 110.771 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.514 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.9 mmtp -67.51 -10.14 48.86 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 178.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -133.48 -12.04 2.74 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.984 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.5 mpp_? 52.28 46.18 27.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 -178.088 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -114.01 -171.15 1.85 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.607 0.717 . . . . 0.0 110.071 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.452 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -126.1 103.64 7.82 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 177.357 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.02 86.84 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.27 0 O-C-N 120.507 -1.371 . . . . 0.0 111.15 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.37 9.31 10.32 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.451 ' C ' ' H ' ' A' ' 76' ' ' HIS . 5.6 mmpt? -77.65 54.18 1.18 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.679 -0.638 . . . . 0.0 110.029 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.506 HG22 ' H ' ' A' ' 42' ' ' GLY . 6.1 p -59.13 -5.99 0.79 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.864 -1.147 . . . . 0.0 108.769 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.451 ' H ' ' C ' ' A' ' 74' ' ' LYS . 36.1 m80 -59.41 -40.78 87.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.519 -0.738 . . . . 0.0 110.971 -179.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -121.18 -162.46 0.97 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.608 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -120.24 -164.17 1.07 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.973 -1.079 . . . . 0.0 110.481 -178.257 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.631 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.1 mp -71.63 -59.26 2.85 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -47.01 -52.67 14.26 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.018 0.914 . . . . 0.0 109.72 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.608 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.4 mmtt -45.31 -55.06 6.33 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.674 0.75 . . . . 0.0 109.664 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -71.35 -43.62 66.61 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.256 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.37 4.21 8.38 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 108.819 -1.713 . . . . 0.0 108.819 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.518 HG22 ' N ' ' A' ' 85' ' ' GLN . 38.4 mt -61.69 161.05 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 O-C-N 121.582 -0.952 . . . . 0.0 109.35 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.518 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.7 tp60 -172.13 -161.96 0.19 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.361 -0.837 . . . . 0.0 109.143 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.83 -23.98 60.84 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.504 -0.748 . . . . 0.0 109.482 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -74.5 -11.92 60.35 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.474 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.46 113.15 25.34 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.9 mmtp -94.78 118.12 31.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.911 -1.118 . . . . 0.0 109.69 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HG ' HD12 ' A' ' 20' ' ' LEU . 11.0 mt -94.41 175.99 6.47 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.561 0.696 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.577 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -134.87 161.38 35.4 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 61.8 t80 -120.42 91.23 3.49 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -110.06 162.03 22.05 Favored Pre-proline 0 N--CA 1.507 2.386 0 O-C-N 121.848 -0.533 . . . . 0.0 110.291 -177.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.42 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 37.4 Cg_endo . . . . . 0 N--CA 1.497 1.73 0 C-N-CA 122.915 2.41 . . . . 0.0 111.77 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 541' ' ' TYR . . . . . 0.518 ' CD2' ' O ' ' B' ' 541' ' ' TYR . 73.2 t80 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -60.93 -168.26 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.192 -0.943 . . . . 0.0 109.663 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.94 -35.13 10.17 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.541 ' CG ' HH21 ' B' ' 544' ' ' ARG . 0.2 OUTLIER -57.15 127.92 34.36 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.45 -0.781 . . . . 0.0 109.641 -179.906 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.517 ' HG2' HH21 ' B' ' 545' ' ' ARG . 1.0 OUTLIER -73.38 -148.75 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.289 0 O-C-N 121.166 -0.959 . . . . 0.0 109.58 179.875 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . 176.41 -108.54 0.26 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.533 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m -162.29 116.45 1.82 Allowed 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -58.13 134.4 56.43 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 120.942 -1.099 . . . . 0.0 110.713 -178.005 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.504 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.1 OUTLIER -82.8 104.0 12.71 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.866 -1.901 . . . . 0.0 105.866 178.206 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.0 t -48.7 124.75 8.86 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 122.034 0.921 . . . . 0.0 109.318 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 110.23 -37.21 3.86 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.8 m -101.86 -35.99 8.82 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.35 56.41 6.4 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.815 1.293 . . . . 0.0 109.427 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -140.45 122.44 9.61 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.23 133.46 9.02 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 CA-C-N 120.539 1.228 . . . . 0.0 114.504 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.533 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -92.04 98.15 8.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.66 91.14 4.73 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.992 0.901 . . . . 0.0 111.238 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.07 -96.36 0.15 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 107.283 -2.327 . . . . 0.0 107.283 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.475 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.8 mmt-85 -112.39 149.86 31.92 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -145.04 126.64 15.11 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.911 -1.118 . . . . 0.0 111.521 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 43.0 mt -91.4 146.41 6.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.6 m -120.13 146.39 46.01 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.873 0.844 . . . . 0.0 108.945 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.716 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.74 -129.22 0.26 Allowed 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.551 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.88 25.94 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 109.245 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.716 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.99 -8.13 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -178.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 150.63 28.11 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 567' ' ' LYS . . . . . 0.414 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 18.2 mmmt -96.49 174.72 6.71 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 568' ' ' PHE . . . . . 0.414 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 0.9 OUTLIER -162.27 132.07 4.58 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 117.568 -1.653 . . . . 0.0 111.31 -178.607 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.592 ' O ' ' N ' ' B' ' 571' ' ' GLU . 2.6 m80 -50.59 112.27 2.76 Favored Pre-proline 0 C--N 1.297 -1.687 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 176.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.431 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 51.1 Cg_exo -44.62 -4.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.415 0 CA-C-N 120.186 1.102 . . . . 0.0 114.395 -178.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.967 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.8 mt-10 -112.16 -53.66 2.69 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 122.749 1.261 . . . . 0.0 108.814 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -46.78 -15.15 0.03 OUTLIER 'General case' 0 C--N 1.285 -2.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.453 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.519 ' N ' ' O ' ' B' ' 571' ' ' GLU . 55.1 t80 -118.53 54.08 0.96 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.967 HG13 ' O ' ' B' ' 571' ' ' GLU . 14.1 m -91.83 176.13 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.593 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -71.39 141.2 50.35 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 576' ' ' ALA . . . . . 0.49 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.87 74.88 6.48 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 116.377 -2.129 . . . . 0.0 108.486 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -150.85 -60.58 0.18 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 100.839 -3.763 . . . . 0.0 100.839 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.6 OUTLIER -104.8 155.28 19.04 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 176.156 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 1.066 ' H ' HD22 ' B' ' 579' ' ' LEU . 0.0 OUTLIER -105.55 14.21 28.88 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.033 -1.042 . . . . 0.0 111.265 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.573 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -102.86 -38.99 7.16 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.415 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.4 tp-100 -162.42 142.0 9.46 Favored 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 122.447 2.385 . . . . 0.0 115.979 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.593 HD13 ' HB2' ' B' ' 575' ' ' CYS . 22.7 tp -137.41 168.4 19.72 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 174.424 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.8 m-20 -150.54 133.85 16.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.859 -1.15 . . . . 0.0 109.843 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -50.39 -18.85 0.7 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.563 0.697 . . . . 0.0 109.697 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.76 -21.26 51.33 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 586' ' ' THR . . . . . 0.449 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.5 p -134.62 26.79 3.71 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.58 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.65 108.37 19.77 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 122.589 1.185 . . . . 0.0 110.256 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.49 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.73 169.85 8.37 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.063 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.422 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.7 tt0 -151.34 157.19 42.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.653 -1.279 . . . . 0.0 110.832 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.481 ' OE1' ' CD1' ' B' ' 604' ' ' PHE . 3.0 tp60 -153.22 146.07 24.42 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.487 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.3 OUTLIER 45.03 23.54 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.057 -1.027 . . . . 0.0 110.064 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.487 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.2 m-20 82.66 -4.82 1.35 Allowed 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.811 -0.556 . . . . 0.0 110.702 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 39.1 mttm -91.57 124.54 60.54 Favored Pre-proline 0 C--N 1.295 -1.787 0 O-C-N 121.302 -0.874 . . . . 0.0 109.698 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.492 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.8 Cg_exo -49.09 163.64 0.32 Allowed 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 119.971 1.025 . . . . 0.0 112.479 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.499 ' OH ' HD21 ' A' ' 46' ' ' LEU . 13.5 m-85 -170.73 141.69 1.86 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.335 -0.853 . . . . 0.0 109.796 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 596' ' ' CYS . . . . . 0.464 ' SG ' ' CB ' ' B' ' 575' ' ' CYS . 6.0 m -74.49 157.05 36.23 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -60.83 -57.31 13.21 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.56 -30.18 2.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.454 -0.778 . . . . 0.0 108.936 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 8.6 m -79.43 -62.56 1.65 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.545 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.3 OUTLIER -56.73 -55.96 27.51 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-O 121.15 0.5 . . . . 0.0 110.585 -179.685 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.637 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -47.66 -42.16 23.96 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.228 -0.92 . . . . 0.0 109.091 -178.566 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.472 ' O ' HG21 ' A' ' 75' ' ' THR . 28.3 tttt -59.67 -20.9 59.27 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.187 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.764 HD13 HD12 ' A' ' 46' ' ' LEU . 6.6 mt -90.6 -56.74 3.08 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.131 -0.98 . . . . 0.0 111.509 -178.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.481 ' CD1' ' OE1' ' B' ' 590' ' ' GLN . 4.2 m-85 -89.37 30.64 0.97 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.874 -1.141 . . . . 0.0 110.396 -178.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.503 ' SG ' ' O ' ' B' ' 601' ' ' LEU . 3.2 m . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.912 -1.117 . . . . 0.0 109.291 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 ttt . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.74 -56.05 0.2 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.014 -1.054 . . . . 0.0 108.619 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 74.6 mt -44.92 -85.15 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 122.055 0.931 . . . . 0.0 109.487 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.4 t0 46.38 24.19 0.27 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 121.845 0.831 . . . . 0.0 109.337 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.09 -14.14 58.67 Favored Glycine 0 N--CA 1.487 2.037 0 N-CA-C 108.129 -1.989 . . . . 0.0 108.129 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.685 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -110.53 -98.86 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.667 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.136 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.549 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -152.2 -98.42 0.05 Allowed 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.94 -1.1 . . . . 0.0 109.595 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.549 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -145.45 -62.69 0.02 OUTLIER Pre-proline 0 N--CA 1.499 2.017 0 O-C-N 120.974 -1.079 . . . . 0.0 110.74 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -43.44 -32.56 3.63 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 CA-C-N 121.166 1.452 . . . . 0.0 110.091 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -117.04 -24.07 7.72 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.064 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.34 4.11 84.13 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.945 -1.262 . . . . 0.0 109.945 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.52 ' N ' ' O ' ' A' ' 8' ' ' MET . 17.5 t -167.68 -25.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.026 -1.279 . . . . 0.0 111.043 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 54.22 -127.92 2.31 Favored 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -171.35 -39.0 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.02 -1.05 . . . . 0.0 109.782 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -157.59 9.03 0.17 Allowed 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.209 -0.932 . . . . 0.0 110.044 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 80.97 42.29 9.73 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 108.168 -1.973 . . . . 0.0 108.168 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.675 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 12.4 p -79.45 129.62 34.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.481 -1.011 . . . . 0.0 109.648 -179.34 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.548 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -153.04 137.67 16.88 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.589 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -90.38 132.3 35.68 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.014 -1.053 . . . . 0.0 110.1 -179.575 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.524 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.42 134.2 34.48 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.92 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.27 145.73 35.25 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.169 -0.957 . . . . 0.0 108.69 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.2 t -138.51 106.7 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-O 121.78 0.8 . . . . 0.0 110.193 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.521 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 16.4 m170 -82.11 103.97 12.11 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.543 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -73.97 108.61 5.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 118.654 -1.219 . . . . 0.0 108.22 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.89 -23.46 38.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 109.057 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -78.84 -8.33 58.71 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.1 mt -130.15 -21.06 2.99 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.543 ' N ' ' O ' ' A' ' 24' ' ' VAL . 26.5 t-20 76.98 12.55 2.26 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 122.033 -0.417 . . . . 0.0 110.143 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 16.5 mtp-105 -98.3 -178.12 3.93 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 121.03 -1.044 . . . . 0.0 109.856 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.521 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 20.3 m-20 -135.97 116.68 13.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 32' ' ' THR . 29.6 t -115.93 158.04 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-O 121.626 0.727 . . . . 0.0 109.772 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.453 ' N ' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -132.72 131.05 40.81 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.912 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.43 HD22 ' O ' ' A' ' 32' ' ' THR . 2.7 mm? -115.45 118.11 32.26 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.675 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -60.41 139.59 57.61 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 178.459 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.599 ' HB ' HG11 ' A' ' 39' ' ' VAL . 5.5 m -160.26 -175.16 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.443 0 CA-C-O 121.882 0.849 . . . . 0.0 109.741 -177.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.519 ' O ' HG12 ' A' ' 39' ' ' VAL . 15.1 p -140.49 173.05 11.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.97 49.74 4.02 Favored Glycine 0 C--N 1.29 -2.009 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -153.5 1.69 0.26 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.76 -0.847 . . . . 0.0 109.356 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.599 HG11 ' HB ' ' A' ' 35' ' ' VAL . 0.2 OUTLIER -85.8 151.41 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.717 -1.239 . . . . 0.0 108.303 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.489 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.1 OUTLIER -87.67 142.75 27.59 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 121.235 -0.916 . . . . 0.0 109.17 179.798 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.65 HD13 ' HB3' ' A' ' 72' ' ' LEU . 38.6 mt -47.16 -57.81 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-O 122.179 0.99 . . . . 0.0 109.222 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.413 ' H ' HG23 ' A' ' 75' ' ' THR . . . -53.69 -14.36 3.71 Favored Glycine 0 C--N 1.295 -1.733 0 N-CA-C 108.512 -1.835 . . . . 0.0 108.512 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.79 -25.48 62.48 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -79.58 -55.09 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.413 -1.051 . . . . 0.0 109.757 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -21.95 4.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.449 -1.407 . . . . 0.0 108.585 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.504 ' C ' HD23 ' A' ' 46' ' ' LEU . 3.2 tt -71.69 -58.32 3.59 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -61.76 -51.87 66.56 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.306 -0.871 . . . . 0.0 110.625 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.432 HD21 ' CD1' ' A' ' 92' ' ' PHE . 57.3 tp -44.82 -54.24 6.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.089 -1.007 . . . . 0.0 110.604 -178.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.88 -44.06 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 120.722 -1.236 . . . . 0.0 110.098 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -45.01 -38.45 4.81 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.125 -0.985 . . . . 0.0 109.986 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.532 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.3 mtmp? -67.91 -48.5 65.81 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.381 -0.824 . . . . 0.0 110.421 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.8 OUTLIER -65.0 -68.11 0.39 Allowed 'General case' 0 C--N 1.307 -1.262 0 O-C-N 120.877 -1.139 . . . . 0.0 108.33 179.956 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 10.2 t0 80.36 88.23 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.119 0.962 . . . . 0.0 110.377 178.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.488 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -169.78 140.12 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.285 -2.223 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.276 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -67.32 35.54 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.639 -0.663 . . . . 0.0 110.567 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.488 ' H ' ' C ' ' A' ' 54' ' ' VAL . 13.6 ttmm -78.81 144.9 34.64 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 118.385 -1.326 . . . . 0.0 108.85 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.526 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 4.4 m-20 -54.73 96.11 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.628 -0.67 . . . . 0.0 110.073 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.47 ' O ' ' N ' ' A' ' 61' ' ' HIS . 47.6 m95 -107.21 -29.64 9.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.329 -0.857 . . . . 0.0 109.612 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 p -44.33 -42.89 7.11 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.617 -0.677 . . . . 0.0 110.149 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 15.7 t0 -75.1 -15.87 60.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.385 -0.822 . . . . 0.0 109.621 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.526 ' CE1' ' O ' ' A' ' 57' ' ' ASP . 2.4 m80 -85.18 128.36 34.64 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.209 -0.932 . . . . 0.0 110.789 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -139.3 176.82 8.38 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.775 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.7 mm? -94.75 145.12 25.09 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.818 -1.176 . . . . 0.0 110.304 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.516 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.21 151.53 49.15 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.539 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.84 94.7 5.08 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.078 -1.014 . . . . 0.0 108.97 -179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.415 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 10.4 pt-20 -56.04 -23.69 34.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.23 -0.919 . . . . 0.0 110.762 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.523 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.9 mmtp -68.39 -9.57 49.21 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 178.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.27 -12.14 2.8 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.983 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.539 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.65 46.65 26.32 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.8 t -115.06 -170.73 1.81 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.313 0.578 . . . . 0.0 109.774 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.532 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.55 97.42 4.54 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.525 -1.657 . . . . 0.0 106.525 177.212 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 41' ' ' ILE . 11.1 mt -60.85 85.32 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.901 -1.124 . . . . 0.0 110.05 -176.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -119.97 10.27 11.46 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.461 ' HD3' HD12 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -91.54 68.52 5.7 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.427 -0.796 . . . . 0.0 109.398 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.417 ' O ' ' O ' ' B' ' 605' ' ' CYS . 3.7 m -60.24 -5.51 1.13 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.995 -1.065 . . . . 0.0 108.968 179.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.44 ' H ' ' C ' ' A' ' 74' ' ' LYS . 40.1 m80 -59.27 -61.75 2.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.836 . . . . 0.0 112.099 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.461 ' CH2' HD11 ' A' ' 41' ' ' ILE . 11.7 p-90 -88.07 -159.01 0.5 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.689 -1.257 . . . . 0.0 110.852 -178.011 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.664 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -139.23 165.27 27.62 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.92 -1.113 . . . . 0.0 110.24 -178.208 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.471 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 11.1 mp -38.95 -65.4 0.37 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.076 0.941 . . . . 0.0 109.721 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -44.49 -52.29 8.04 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.852 0.834 . . . . 0.0 110.259 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.664 ' CG ' ' H ' ' A' ' 78' ' ' THR . 40.9 mmtt -45.25 -54.65 6.76 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.46 0.648 . . . . 0.0 109.722 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.86 -43.85 57.34 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.098 -1.041 . . . . 0.0 108.908 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 119.13 11.64 7.4 Favored Glycine 0 N--CA 1.5 2.913 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.498 HG22 ' N ' ' A' ' 85' ' ' GLN . 33.7 mt -61.21 161.19 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.574 -0.957 . . . . 0.0 108.866 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.498 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.3 tp60 -161.99 -169.15 2.11 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.297 -0.877 . . . . 0.0 109.239 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.537 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -69.91 -19.97 63.38 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.614 -0.679 . . . . 0.0 109.562 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.3 p30 -80.47 -8.26 59.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.289 -0.882 . . . . 0.0 109.184 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.524 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -93.07 113.35 25.59 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -93.28 115.88 28.46 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.767 -1.208 . . . . 0.0 109.551 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.406 ' HG ' HD12 ' A' ' 20' ' ' LEU . 9.9 mt -97.55 176.99 5.65 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.698 0.761 . . . . 0.0 109.507 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.516 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -132.81 168.59 18.11 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.194 -1.409 . . . . 0.0 107.194 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.432 ' CD1' HD21 ' A' ' 48' ' ' LEU . 20.2 t80 -133.31 99.35 4.5 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.5 162.32 42.63 Favored Pre-proline 0 N--CA 1.504 2.23 0 C-N-CA 120.214 -0.595 . . . . 0.0 111.642 -176.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_endo . . . . . 0 N--CA 1.499 1.85 0 C-N-CA 123.094 2.53 . . . . 0.0 111.763 178.529 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.306 0.574 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 542' ' ' HIS . . . . . 0.458 ' ND1' ' N ' ' B' ' 542' ' ' HIS . 2.9 m80 -61.59 -168.11 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.282 -0.886 . . . . 0.0 109.635 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -141.92 -0.02 1.36 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.333 -0.854 . . . . 0.0 109.695 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.7 103.67 14.71 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.072 -1.017 . . . . 0.0 109.561 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.427 ' H ' ' HD3' ' B' ' 545' ' ' ARG . 0.1 OUTLIER -80.9 -161.67 0.41 Allowed 'General case' 0 C--N 1.307 -1.28 0 O-C-N 121.144 -0.973 . . . . 0.0 108.985 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -166.69 -101.49 0.15 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m -168.41 119.09 0.78 Allowed 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -59.03 135.04 57.5 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.783 -1.198 . . . . 0.0 110.211 -178.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.52 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.62 103.73 13.17 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.6 t -48.82 125.1 9.6 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-O 122.035 0.921 . . . . 0.0 109.639 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.5 -34.62 5.38 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 106.479 -2.648 . . . . 0.0 106.479 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.3 m -105.31 -35.26 7.6 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 54.55 56.42 6.84 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.824 1.297 . . . . 0.0 109.881 -178.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -140.71 123.62 9.92 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -44.24 134.09 8.94 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 CA-C-N 120.574 1.241 . . . . 0.0 114.433 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.3 mt -91.74 98.31 8.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 557' ' ' THR . . . . . 0.429 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.5 p -99.46 91.01 4.72 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.286 -0.884 . . . . 0.0 111.159 -177.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.74 -96.2 0.15 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.462 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.6 mmt-85 -113.88 150.58 33.44 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 177.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 26.5 p -144.46 126.66 15.67 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.951 -1.093 . . . . 0.0 111.76 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 40.9 mt -91.32 146.68 5.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.438 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 12.2 m -120.72 146.53 46.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 121.81 0.814 . . . . 0.0 108.897 179.486 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.724 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.7 -129.02 0.26 Allowed 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.5 mtp -65.79 25.89 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.559 -0.713 . . . . 0.0 109.147 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.724 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.11 -8.51 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 -178.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.25 148.7 28.24 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -95.94 174.65 6.83 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.49 137.57 8.04 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.142 -1.423 . . . . 0.0 110.121 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.612 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.0 m80 -57.9 117.05 16.65 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.436 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 50.4 Cg_exo -44.11 -8.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.302 0 CA-C-N 120.114 1.076 . . . . 0.0 112.758 -178.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.717 ' O ' HG13 ' B' ' 574' ' ' VAL . 8.2 mt-10 -106.41 -53.16 2.67 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 122.149 0.976 . . . . 0.0 109.623 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -55.5 -5.0 0.11 Allowed 'General case' 0 C--N 1.292 -1.927 0 O-C-N 120.312 -1.493 . . . . 0.0 109.495 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.492 ' H ' ' C ' ' B' ' 571' ' ' GLU . 39.8 t80 -125.44 52.96 1.58 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.717 HG13 ' O ' ' B' ' 571' ' ' GLU . 11.6 m -92.93 177.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.639 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -80.39 141.85 34.95 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.53 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.4 75.6 3.89 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 116.842 -1.943 . . . . 0.0 109.915 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 577' ' ' PHE . . . . . 0.407 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 69.1 t80 -153.33 -54.12 0.11 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 102.459 -3.163 . . . . 0.0 102.459 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.521 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.7 p -126.75 77.75 1.74 Allowed 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 111.68 -2.509 . . . . 0.0 104.396 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 0.703 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.3 mp -53.04 16.85 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.521 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.1 -37.71 21.67 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 119.545 -1.972 . . . . 0.0 112.233 -178.718 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.488 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.6 tp-100 -161.54 143.89 11.92 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 119.54 -1.975 . . . . 0.0 113.843 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.639 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.5 tp -136.62 170.59 15.82 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' B' ' 587' ' ' PHE . 70.3 m-20 -149.61 131.79 15.44 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.182 -0.949 . . . . 0.0 109.455 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.438 ' HE3' ' H ' ' B' ' 562' ' ' THR . 14.7 ptpt -51.11 -19.16 1.03 Allowed 'General case' 0 C--N 1.302 -1.494 0 CA-C-O 121.564 0.697 . . . . 0.0 109.813 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.0 -20.54 55.28 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -134.34 26.62 3.8 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.52 107.73 19.35 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 122.657 1.218 . . . . 0.0 110.389 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.97 166.25 10.56 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.428 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.1 tt0 -153.01 157.28 40.3 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.815 -1.178 . . . . 0.0 110.653 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.428 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 1.6 tp-100 -156.22 146.13 21.2 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.477 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 46.41 23.65 0.24 Allowed 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.041 -1.037 . . . . 0.0 109.643 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 81.55 -5.74 1.55 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.782 -0.574 . . . . 0.0 110.8 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -88.34 116.25 65.67 Favored Pre-proline 0 C--N 1.294 -1.806 0 O-C-N 121.206 -0.934 . . . . 0.0 109.54 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.515 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 42.6 Cg_exo -49.51 164.2 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 CA-C-N 119.908 1.003 . . . . 0.0 112.141 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.515 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.77 140.03 1.6 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.179 -0.951 . . . . 0.0 110.163 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 11.0 m -73.51 152.88 40.53 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 174.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -55.69 -57.46 11.9 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -45.35 -29.44 1.05 Allowed 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.58 -0.7 . . . . 0.0 109.316 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 76.2 m -84.62 -66.17 0.92 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.611 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -43.86 -56.5 3.84 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.656 0.741 . . . . 0.0 109.577 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.643 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.73 -43.31 62.83 Favored 'General case' 0 C--N 1.293 -1.854 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -178.802 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -64.69 -20.48 66.34 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.705 -1.247 . . . . 0.0 110.807 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -90.17 -56.46 3.21 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.3 -1.5 . . . . 0.0 112.067 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.29 30.73 4.37 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.223 -0.923 . . . . 0.0 112.381 -176.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.417 ' O ' ' O ' ' A' ' 75' ' ' THR . 2.4 t . . . . . 0 N--CA 1.5 2.058 0 O-C-N 120.604 -1.31 . . . . 0.0 108.805 178.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.297 0.57 . . . . 0.0 109.595 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.89 -47.47 0.13 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.27 -0.894 . . . . 0.0 108.756 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.542 ' C ' ' H ' ' A' ' 5' ' ' GLY . 57.0 mt -45.68 -76.37 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.994 0.902 . . . . 0.0 109.369 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.515 ' OD2' HD11 ' A' ' 6' ' ' ILE . 9.7 t0 61.38 -7.09 0.1 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.942 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.542 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 116.75 -11.89 15.44 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 108.478 -1.849 . . . . 0.0 108.478 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.622 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -116.2 -109.46 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.023 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.503 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -159.47 -95.09 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.255 0 O-C-N 120.313 -1.492 . . . . 0.0 110.394 -179.297 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.503 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -130.46 -53.85 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.556 0 O-C-N 120.951 -1.093 . . . . 0.0 111.661 -179.16 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -56.11 -28.73 71.56 Favored 'Trans proline' 0 N--CA 1.497 1.703 0 CA-C-N 121.074 1.419 . . . . 0.0 110.345 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -119.61 -27.5 5.49 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.33 1.5 88.62 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 13.1 t -157.92 -35.57 0.07 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.281 -1.129 . . . . 0.0 109.416 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.612 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 1.7 t80 77.97 -33.16 0.17 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.612 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 169.92 -42.2 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.473 ' N ' ' SG ' ' A' ' 12' ' ' CYS . 29.8 t70 -159.21 9.13 0.12 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.216 -0.928 . . . . 0.0 110.281 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.531 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 100.41 38.48 3.49 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 108.443 -1.863 . . . . 0.0 108.443 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.92 122.4 23.37 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.568 -0.96 . . . . 0.0 109.532 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.531 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -133.01 124.55 27.9 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.616 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.12 128.71 34.21 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.819 -1.176 . . . . 0.0 109.134 -179.798 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.516 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.01 133.35 34.68 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.573 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.55 145.5 34.8 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.396 -0.815 . . . . 0.0 110.019 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.8 t -135.2 100.42 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.762 0.792 . . . . 0.0 109.066 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.534 ' CE1' ' OD1' ' A' ' 30' ' ' ASP . 7.7 m-70 -77.94 104.06 8.26 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.549 HG13 ' CD1' ' A' ' 92' ' ' PHE . 4.8 t -74.75 117.88 19.62 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.128 -1.429 . . . . 0.0 108.965 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.423 ' H ' HG23 ' A' ' 25' ' ' THR . 0.6 OUTLIER -85.27 -23.6 28.11 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.371 -0.831 . . . . 0.0 109.72 -179.333 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.481 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -79.92 -8.86 59.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.0 108.373 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.404 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.0 mt -129.0 -23.62 3.02 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.523 ' N ' ' O ' ' A' ' 24' ' ' VAL . 29.2 t-20 76.22 12.11 2.78 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -94.92 -177.96 4.34 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.197 -0.939 . . . . 0.0 109.445 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.534 ' OD1' ' CE1' ' A' ' 23' ' ' HIS . 2.1 m-20 -136.7 113.19 10.06 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.401 HG12 ' N ' ' A' ' 32' ' ' THR . 21.4 t -107.76 157.48 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.494 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.2 139.79 47.19 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 2.3 mm? -120.16 112.55 19.23 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.663 -0.648 . . . . 0.0 109.56 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.496 ' NH1' ' CG ' ' A' ' 13' ' ' TYR . 15.7 tpt180 -61.47 107.01 0.72 Allowed 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -135.33 -168.94 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 CA-C-O 121.842 0.83 . . . . 0.0 110.339 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.6 p -141.84 173.35 11.59 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.17 44.52 2.65 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.431 ' C ' HG21 ' A' ' 78' ' ' THR . 0.2 OUTLIER -144.67 2.95 1.09 Allowed 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.615 -0.932 . . . . 0.0 108.843 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.575 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -89.08 135.21 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 O-C-N 121.146 -0.971 . . . . 0.0 110.259 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.488 ' O ' ' N ' ' A' ' 43' ' ' GLY . 9.4 m-70 -78.4 148.2 33.75 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.921 -1.112 . . . . 0.0 108.866 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.529 HD12 ' O ' ' A' ' 74' ' ' LYS . 38.7 mt -47.36 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.131 -0.981 . . . . 0.0 109.251 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.56 -13.36 2.87 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 108.625 -1.79 . . . . 0.0 108.625 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -82.23 -26.94 46.28 Favored Glycine 0 N--CA 1.483 1.833 0 N-CA-C 109.261 -1.536 . . . . 0.0 109.261 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.7 t -80.79 -55.26 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -1.105 . . . . 0.0 109.543 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.463 ' SD ' HD22 ' B' ' 603' ' ' LEU . 0.0 OUTLIER -49.56 -40.58 38.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.766 -1.209 . . . . 0.0 108.996 179.771 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.8 tt -54.47 -58.88 5.73 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.079 -1.013 . . . . 0.0 109.35 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -59.39 -57.84 11.22 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.246 -0.909 . . . . 0.0 110.919 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.5 tp -44.81 -41.73 7.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.366 -0.834 . . . . 0.0 110.182 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.634 HG22 ' CD2' ' A' ' 58' ' ' TRP . 93.2 t -74.67 -43.49 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.821 -1.174 . . . . 0.0 109.52 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -45.79 -38.87 7.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.257 -0.902 . . . . 0.0 108.933 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.533 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 54.5 mttp -67.44 -57.38 6.66 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.479 -0.763 . . . . 0.0 109.294 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.536 ' C ' ' H ' ' A' ' 54' ' ' VAL . 3.8 mm? -67.78 -66.22 0.59 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.523 ' N ' ' O ' ' A' ' 49' ' ' VAL . 2.8 t70 78.0 -34.02 0.18 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.875 0.845 . . . . 0.0 109.627 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.536 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.4 p -20.15 134.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.169 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.481 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.453 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.3 tttt -69.9 36.42 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.133 -0.98 . . . . 0.0 110.457 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.494 ' NZ ' ' CB ' ' A' ' 56' ' ' LYS . 3.2 ttpm? -83.97 169.21 15.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.919 . . . . 0.0 108.531 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.535 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -79.71 123.54 27.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.021 -1.049 . . . . 0.0 109.545 -179.828 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.651 ' CZ3' ' CZ ' ' A' ' 92' ' ' PHE . 93.3 m95 -119.09 -48.54 2.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.453 -0.779 . . . . 0.0 109.934 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 p -45.51 -55.97 5.61 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.15 -0.968 . . . . 0.0 109.913 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -55.17 -32.17 61.95 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.535 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 8.8 m-70 -83.55 168.74 16.13 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.981 0.896 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.58 178.57 4.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.817 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -94.24 148.59 22.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.87 -1.144 . . . . 0.0 108.863 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.514 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.35 151.32 48.92 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.799 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.54 94.01 4.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.626 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.41 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 17.9 pt-20 -55.12 -24.2 24.86 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.316 -0.865 . . . . 0.0 111.028 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.534 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.4 mmtp -68.43 -8.81 43.99 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -133.76 -12.89 2.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.783 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 52.68 45.83 27.89 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -178.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -111.86 -173.61 2.28 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.311 0.577 . . . . 0.0 109.732 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.51 5.66 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 177.551 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 35.2 mt -59.81 82.6 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.047 0 O-C-N 120.661 -1.274 . . . . 0.0 110.745 -176.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.553 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -115.38 4.62 14.4 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.539 ' NZ ' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -80.59 72.08 7.49 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' HIS . 46.5 m -44.74 -53.09 7.72 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.204 -0.935 . . . . 0.0 109.742 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.518 ' CE1' ' HG ' ' B' ' 605' ' ' CYS . 45.5 m-70 -51.9 -179.31 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.362 -0.836 . . . . 0.0 109.134 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 23.3 m0 55.92 173.65 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.741 0.781 . . . . 0.0 109.124 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.692 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -131.2 -164.6 1.46 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.681 0.753 . . . . 0.0 109.24 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.563 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.1 mp -70.68 -58.4 3.69 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -43.77 -52.4 6.64 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.67 0.748 . . . . 0.0 109.702 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.692 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.0 mmtt -46.11 -54.43 8.59 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.628 0.727 . . . . 0.0 109.558 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.539 ' OH ' ' NZ ' ' A' ' 74' ' ' LYS . 2.2 m-85 -72.59 -42.05 64.98 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.143 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.19 6.1 14.07 Favored Glycine 0 N--CA 1.5 2.966 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.515 HG22 ' N ' ' A' ' 85' ' ' GLN . 52.0 mt -61.63 161.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.765 -0.844 . . . . 0.0 109.784 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.515 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.7 tp60 -172.05 -162.91 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.19 70.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.368 -0.832 . . . . 0.0 109.956 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.416 ' OD2' ' O ' ' A' ' 87' ' ' ASP . 1.0 OUTLIER -68.42 -13.19 62.12 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -96.81 112.56 24.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -96.23 116.21 28.64 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.928 -1.107 . . . . 0.0 109.594 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.516 ' HG ' HD12 ' A' ' 20' ' ' LEU . 6.8 mt -91.99 175.73 6.76 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.514 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.7 mt-30 -134.68 160.34 38.44 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.651 ' CZ ' ' CZ3' ' A' ' 58' ' ' TRP . 0.1 OUTLIER -119.16 96.45 5.23 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.998 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -136.96 163.35 50.04 Favored Pre-proline 0 N--CA 1.503 2.197 0 O-C-N 121.858 -0.526 . . . . 0.0 110.266 -177.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.493 1.46 0 C-N-CA 122.927 2.418 . . . . 0.0 111.945 179.246 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -76.86 -75.43 0.2 Allowed 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.219 -0.926 . . . . 0.0 109.83 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.416 ' O ' ' O ' ' B' ' 544' ' ' ARG . 2.3 pt-20 -163.83 16.66 0.06 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.293 -0.879 . . . . 0.0 109.628 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.442 ' N ' ' CD ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER 51.17 94.57 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.288 -0.883 . . . . 0.0 108.931 -179.473 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.613 ' CD ' ' H ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -44.56 -45.33 9.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.753 -0.592 . . . . 0.0 110.531 -178.858 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -78.5 -135.6 0.99 Allowed Glycine 0 N--CA 1.487 2.072 0 C-N-CA 119.432 -1.366 . . . . 0.0 110.606 -178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.668 ' H ' ' H ' ' B' ' 556' ' ' ILE . 1.7 m -165.99 119.95 1.16 Allowed 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.6 mp -58.45 133.81 56.1 Favored 'General case' 0 C--N 1.293 -1.85 0 O-C-N 120.696 -1.253 . . . . 0.0 110.74 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.499 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.61 104.08 13.44 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.1 t -50.84 126.66 16.51 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 122.23 1.014 . . . . 0.0 109.728 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.37 5.5 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 106.216 -2.753 . . . . 0.0 106.216 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.7 m -105.72 -36.15 7.15 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.65 56.2 6.42 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 122.719 1.247 . . . . 0.0 110.015 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -140.63 123.92 10.15 Favored Pre-proline 0 N--CA 1.497 1.88 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -44.07 133.94 8.52 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 CA-C-N 120.536 1.227 . . . . 0.0 114.488 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.668 ' H ' ' H ' ' B' ' 547' ' ' SER . 36.9 mt -91.85 98.53 8.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.77 92.13 5.17 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.203 -0.936 . . . . 0.0 111.338 -178.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.27 -95.24 0.15 Allowed Glycine 0 N--CA 1.488 2.118 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 10.0 mmt180 -114.2 151.13 33.23 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.1 p -144.45 126.25 15.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.944 -1.097 . . . . 0.0 111.676 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 41.0 mt -91.43 146.77 5.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.679 ' H ' ' HZ2' ' B' ' 584' ' ' LYS . 8.6 m -117.61 146.6 43.53 Favored 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.709 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.2 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.61 0.719 . . . . 0.0 109.389 -178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.549 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.9 mtp -65.96 26.44 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.709 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.12 -8.96 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 -178.005 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -82.14 161.92 22.65 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -103.77 174.66 5.77 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -161.09 135.07 6.89 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 118.03 -1.468 . . . . 0.0 110.089 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.586 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.8 m80 -55.53 116.0 10.79 Favored Pre-proline 0 C--N 1.301 -1.533 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.435 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 41.8 Cg_exo -46.46 -9.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.384 0 CA-C-N 120.27 1.132 . . . . 0.0 111.642 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.677 ' O ' HG13 ' B' ' 574' ' ' VAL . 10.4 mt-10 -99.75 -52.41 3.46 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.418 1.104 . . . . 0.0 109.738 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 17.6 m170 -59.06 -3.2 0.33 Allowed 'General case' 0 C--N 1.289 -2.028 0 O-C-N 120.41 -1.432 . . . . 0.0 109.618 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.48 ' H ' ' C ' ' B' ' 571' ' ' GLU . 23.2 t80 -132.38 58.86 1.74 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.677 HG13 ' O ' ' B' ' 571' ' ' GLU . 7.7 m -93.91 177.98 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.659 0.742 . . . . 0.0 110.777 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.617 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -75.52 145.64 41.17 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.95 75.7 3.11 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 116.661 -2.015 . . . . 0.0 109.935 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 577' ' ' PHE . . . . . 0.429 ' HE2' HG21 ' A' ' 49' ' ' VAL . 0.9 OUTLIER -153.1 -61.61 0.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 102.264 -3.236 . . . . 0.0 102.264 173.05 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.542 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.3 p -118.41 82.78 1.9 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 111.881 -2.418 . . . . 0.0 105.069 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mp -52.66 16.36 0.0 OUTLIER 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.75 -36.82 21.5 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 119.573 -1.954 . . . . 0.0 112.78 -178.153 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.499 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.6 tp-100 -161.9 142.13 10.33 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 119.262 -2.149 . . . . 0.0 114.941 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.617 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.5 tp -140.38 167.63 21.7 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.526 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.7 m-20 -150.8 134.78 16.73 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.236 -0.915 . . . . 0.0 109.235 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.679 ' HZ2' ' H ' ' B' ' 562' ' ' THR . 1.8 ptpp? -52.58 -18.65 1.84 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.229 -0.919 . . . . 0.0 109.292 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.46 -18.19 57.43 Favored Glycine 0 N--CA 1.485 1.938 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.68 25.17 3.4 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.906 -0.761 . . . . 0.0 108.989 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.554 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -91.08 109.08 20.32 Favored 'General case' 0 N--CA 1.501 2.078 0 CA-C-O 122.564 1.173 . . . . 0.0 110.029 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -105.7 169.91 8.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 107.516 -1.291 . . . . 0.0 107.516 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.425 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.2 tt0 -152.62 157.19 40.63 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.737 -1.227 . . . . 0.0 110.616 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.425 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 1.8 tp60 -157.1 146.52 20.35 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.473 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.0 OUTLIER 47.89 22.93 0.41 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.923 -1.11 . . . . 0.0 109.59 -179.323 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.473 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 81.81 -7.03 1.43 Allowed 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.789 -0.57 . . . . 0.0 111.234 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 593' ' ' LYS . . . . . 0.402 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 38.3 mttm -89.59 121.07 69.5 Favored Pre-proline 0 C--N 1.297 -1.711 0 O-C-N 121.033 -1.042 . . . . 0.0 109.711 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.537 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.5 Cg_exo -49.61 164.18 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.235 0 CA-C-N 120.174 1.098 . . . . 0.0 111.656 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.537 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.6 m-85 -170.28 139.95 1.81 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.242 -0.911 . . . . 0.0 109.873 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 3.8 m -69.69 154.08 42.49 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 175.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -59.09 -57.59 12.39 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 178.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.8 -29.68 1.41 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 4.6 m -82.43 -67.55 0.78 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.639 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.32 -59.16 3.1 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.523 0.678 . . . . 0.0 110.224 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.65 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -50.44 -42.7 54.53 Favored 'General case' 0 C--N 1.293 -1.851 0 O-C-N 121.539 -0.725 . . . . 0.0 109.429 -178.567 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 8.7 tptp -62.78 -22.84 66.89 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.089 -1.007 . . . . 0.0 111.199 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.468 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -92.92 -44.69 8.32 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.325 -1.484 . . . . 0.0 110.26 -179.07 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.447 ' O ' ' C ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -120.06 32.85 5.85 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.528 -0.733 . . . . 0.0 109.831 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.518 ' HG ' ' CE1' ' A' ' 76' ' ' HIS . 0.8 OUTLIER . . . . . 0 N--CA 1.503 2.2 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.624 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.624 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -143.37 -55.09 0.39 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.116 -0.99 . . . . 0.0 108.607 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.5 mt -43.9 -80.43 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.294 1.045 . . . . 0.0 109.435 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.433 ' C ' ' N ' ' A' ' 6' ' ' ILE . 17.0 t70 52.86 14.45 0.44 Allowed 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.836 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.49 -12.95 35.34 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 106.727 -2.549 . . . . 0.0 106.727 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.659 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -112.5 -107.54 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -179.834 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.424 ' HB3' ' H ' ' A' ' 8' ' ' MET . 4.4 tpp180 -172.31 -90.13 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.16 0 O-C-N 120.846 -1.159 . . . . 0.0 111.494 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.555 ' O ' ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -120.33 -54.04 0.04 OUTLIER Pre-proline 0 N--CA 1.501 2.088 0 O-C-N 121.844 -0.535 . . . . 0.0 112.215 -176.351 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -58.67 -40.28 74.76 Favored 'Trans proline' 0 N--CA 1.5 1.861 0 C-N-CA 121.686 1.591 . . . . 0.0 111.496 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -112.71 -23.25 10.29 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.62 -4.55 90.19 Favored Glycine 0 N--CA 1.484 1.852 0 N-CA-C 108.271 -1.932 . . . . 0.0 108.271 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 9.0 t -173.66 -85.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.503 -0.998 . . . . 0.0 109.744 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.555 ' N ' ' O ' ' A' ' 8' ' ' MET . 11.6 t80 -176.57 -65.79 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -172.54 -48.95 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -146.2 2.9 0.89 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.432 -0.792 . . . . 0.0 109.431 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.03 16.4 41.42 Favored Glycine 0 N--CA 1.494 2.502 0 N-CA-C 108.542 -1.823 . . . . 0.0 108.542 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.5 p -93.92 122.07 36.04 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.551 -0.97 . . . . 0.0 109.475 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.441 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -125.78 123.51 38.94 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.617 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.23 129.99 34.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 108.807 -179.806 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.446 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.34 131.46 35.06 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.66 34.68 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.287 -0.883 . . . . 0.0 110.098 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 33.1 t -136.39 106.96 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 CA-C-O 121.67 0.747 . . . . 0.0 109.21 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.502 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 5.9 m170 -77.81 103.43 7.75 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 178.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.564 HG13 ' CD1' ' A' ' 92' ' ' PHE . 2.1 t -69.35 107.38 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.621 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' LEU . 11.5 p -74.27 -65.31 0.86 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.542 -0.724 . . . . 0.0 111.122 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' OG1' ' A' ' 25' ' ' THR . 19.3 t0 -46.9 -13.15 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.088 -1.007 . . . . 0.0 110.027 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.549 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.5 mm? -112.12 -48.03 3.07 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.424 -0.797 . . . . 0.0 109.062 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 36.4 t-20 98.02 13.06 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.426 HH21 ' HB2' ' A' ' 29' ' ' ARG . 5.1 mtp-105 -94.77 -176.85 4.0 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.125 0.965 . . . . 0.0 109.702 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.502 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 2.4 m-20 -138.34 116.02 11.41 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.438 HG12 ' N ' ' A' ' 32' ' ' THR . 42.6 t -113.15 155.96 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-O 121.532 0.682 . . . . 0.0 109.341 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -134.56 133.92 40.79 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.551 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD22 ' O ' ' A' ' 32' ' ' THR . 2.7 mm? -113.85 113.16 24.51 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -60.26 107.58 0.67 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.4 m -134.5 -169.77 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.822 0.82 . . . . 0.0 110.114 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.9 p -142.61 173.25 11.7 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.441 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -78.89 46.61 2.95 Favored Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' C ' HG21 ' A' ' 78' ' ' THR . 6.4 pt-20 -148.57 4.89 0.69 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.675 -0.897 . . . . 0.0 108.982 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.615 ' O ' HG22 ' A' ' 78' ' ' THR . 2.3 m -90.49 144.31 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.01 -1.057 . . . . 0.0 110.174 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.492 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 p-80 -84.47 146.45 27.6 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.924 -1.11 . . . . 0.0 108.797 178.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 68.3 mt -48.93 -53.68 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 120.937 -1.102 . . . . 0.0 108.683 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.72 -15.32 4.49 Favored Glycine 0 N--CA 1.485 1.945 0 N-CA-C 108.148 -1.981 . . . . 0.0 108.148 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -76.85 -30.62 55.67 Favored Glycine 0 N--CA 1.483 1.777 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -83.71 -43.47 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.61 -0.935 . . . . 0.0 108.62 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.58 -37.67 12.87 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.112 -0.992 . . . . 0.0 108.389 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -70.21 -61.06 1.92 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.657 -0.652 . . . . 0.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -53.89 -59.22 4.91 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.178 -0.952 . . . . 0.0 111.663 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.18 -44.3 10.76 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.072 -1.017 . . . . 0.0 110.088 -177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 52' ' ' LEU . 24.6 t -70.89 -46.76 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.138 -0.976 . . . . 0.0 109.418 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -44.7 -37.75 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.31 -0.869 . . . . 0.0 109.646 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.487 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 7.8 mtmp? -71.46 -33.8 69.65 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.446 -0.784 . . . . 0.0 109.585 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.1 tp -64.01 -67.9 0.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 t70 67.03 78.76 0.24 Allowed 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.807 0.813 . . . . 0.0 110.572 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.569 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -171.9 149.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.623 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.46 33.97 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.264 -0.897 . . . . 0.0 109.028 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.569 ' H ' ' C ' ' A' ' 54' ' ' VAL . 43.3 tttp -78.07 164.55 24.93 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.313 -0.867 . . . . 0.0 109.146 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.14 91.57 4.34 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.358 -0.838 . . . . 0.0 109.154 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -72.35 -52.05 17.87 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.566 ' C ' ' H ' ' A' ' 61' ' ' HIS . 76.1 p -47.82 -41.84 24.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.62 -0.675 . . . . 0.0 110.008 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -53.99 -4.83 0.06 Allowed 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.25 -0.907 . . . . 0.0 109.091 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.596 ' CG ' ' CE2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -119.12 161.62 20.0 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-O 122.008 0.909 . . . . 0.0 110.129 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . . . -169.99 165.56 9.45 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.76 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -93.35 132.88 37.16 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.603 -1.311 . . . . 0.0 109.637 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -119.73 147.85 44.1 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.618 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -108.29 93.0 4.29 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.112 -0.992 . . . . 0.0 108.551 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -54.95 -24.12 22.35 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.243 -0.911 . . . . 0.0 110.895 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.538 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 26.0 mmtt -68.58 -8.28 40.31 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -133.86 -12.75 2.56 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.553 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.9 OUTLIER 52.86 45.77 28.1 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -178.236 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -113.02 -173.2 2.2 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.423 0.63 . . . . 0.0 109.914 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.71 98.61 5.05 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 177.082 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.417 ' HB3' HD13 ' A' ' 41' ' ' ILE . 21.6 mt -60.67 82.98 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 O-C-N 120.86 -1.15 . . . . 0.0 110.449 -176.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -117.79 6.84 12.35 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.424 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -84.11 68.78 10.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.759 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.414 ' C ' ' O ' ' A' ' 74' ' ' LYS . 28.4 m -40.84 -38.5 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.542 -0.724 . . . . 0.0 110.073 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 15.4 m80 -58.72 171.45 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.266 -0.896 . . . . 0.0 108.964 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 16.7 m0 56.51 168.17 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.61 0.719 . . . . 0.0 109.737 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.665 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -121.7 -164.48 1.15 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.693 0.758 . . . . 0.0 109.477 -178.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 79' ' ' LEU . 4.8 mp -70.41 -59.44 2.86 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -42.82 -51.91 5.25 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.833 0.825 . . . . 0.0 109.755 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.665 ' CG ' ' H ' ' A' ' 78' ' ' THR . 23.0 mmtp -47.16 -54.68 10.05 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.742 0.782 . . . . 0.0 109.362 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.21 -43.37 74.26 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.345 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.77 4.23 17.24 Favored Glycine 0 N--CA 1.499 2.843 0 N-CA-C 108.176 -1.97 . . . . 0.0 108.176 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.499 HG22 ' N ' ' A' ' 85' ' ' GLN . 45.4 mt -61.55 161.21 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.772 -0.84 . . . . 0.0 109.331 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.499 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.6 tp60 -173.15 -166.29 0.34 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.463 -0.773 . . . . 0.0 109.134 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.38 -22.83 64.63 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.409 -0.807 . . . . 0.0 109.968 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -77.41 -11.37 59.83 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.03 113.03 25.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -97.08 118.09 32.72 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.095 -1.003 . . . . 0.0 109.541 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.9 mt -94.63 177.13 6.02 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 4.8 mt-30 -132.89 158.61 42.12 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.329 -1.359 . . . . 0.0 107.329 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.596 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -101.33 109.35 21.18 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.294 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 62' ' ' ALA . 0.4 OUTLIER -162.17 158.78 21.08 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 120.555 -1.34 . . . . 0.0 109.459 -177.67 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo . . . . . 0 N--CA 1.492 1.391 0 C-N-CA 122.471 2.114 . . . . 0.0 111.744 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -67.01 -109.97 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.141 -0.974 . . . . 0.0 110.051 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.415 ' HG2' ' H ' ' B' ' 543' ' ' GLU . 0.1 OUTLIER -45.44 -24.8 0.34 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.307 -0.871 . . . . 0.0 109.603 -179.562 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.45 ' HD3' ' H ' ' B' ' 544' ' ' ARG . 0.0 OUTLIER -81.35 118.33 22.56 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.179 -0.951 . . . . 0.0 109.007 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.48 ' N ' ' CD ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -132.64 -33.86 1.2 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.523 -0.736 . . . . 0.0 109.884 -178.705 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 546' ' ' GLY . . . . . 0.474 ' O ' ' O ' ' B' ' 545' ' ' ARG . . . -52.2 -110.98 0.01 OUTLIER Glycine 0 N--CA 1.496 2.655 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.534 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m -165.7 118.52 1.13 Allowed 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -59.96 135.57 57.75 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 120.938 -1.102 . . . . 0.0 110.431 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.485 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.58 103.93 13.3 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 178.196 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.3 t -51.28 127.08 18.58 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.245 1.021 . . . . 0.0 109.727 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.6 -34.79 5.27 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 106.206 -2.758 . . . . 0.0 106.206 -177.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.5 m -105.4 -35.93 7.34 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.92 56.49 5.96 Favored 'General case' 0 C--N 1.3 -1.557 0 CA-C-O 122.694 1.235 . . . . 0.0 110.079 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp -140.47 123.6 10.14 Favored Pre-proline 0 N--CA 1.496 1.84 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -44.2 134.99 8.66 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.519 1.221 . . . . 0.0 114.743 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.1 mt -94.22 98.29 7.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.6 p -99.85 91.17 4.7 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.218 -0.926 . . . . 0.0 111.25 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.77 -95.9 0.15 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 107.584 -2.206 . . . . 0.0 107.584 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.474 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 11.5 mmt180 -112.48 151.31 30.08 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 22.3 p -144.77 126.29 15.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.957 -1.089 . . . . 0.0 111.438 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.97 146.65 5.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.886 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.4 m -118.28 146.78 44.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-O 121.853 0.835 . . . . 0.0 109.158 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.741 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.69 -129.11 0.26 Allowed 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 121.601 0.715 . . . . 0.0 109.441 -178.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 8.4 mtp -65.75 26.07 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.741 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.14 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.95 162.67 22.61 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -104.87 174.56 5.82 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.24 134.0 7.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.417 -1.427 . . . . 0.0 110.24 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.6 m80 -54.04 114.09 5.98 Favored Pre-proline 0 C--N 1.303 -1.443 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 176.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.434 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 37.0 Cg_exo -46.85 -11.45 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.381 1.172 . . . . 0.0 111.218 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.897 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.7 mt-10 -95.43 -51.79 4.42 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.046 0.927 . . . . 0.0 110.185 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.471 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.1 m170 -60.21 -3.56 0.64 Allowed 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.982 -1.074 . . . . 0.0 109.859 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.42 ' H ' ' C ' ' B' ' 571' ' ' GLU . 24.2 t80 -130.31 57.95 1.69 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.897 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.32 178.04 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-O 121.74 0.781 . . . . 0.0 111.167 -178.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.664 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.93 145.35 30.36 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.169 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -93.56 75.48 4.4 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.794 -1.962 . . . . 0.0 109.239 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -153.46 -64.74 0.15 Allowed 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 102.163 -3.273 . . . . 0.0 102.163 173.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.555 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -114.28 79.43 1.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 111.897 -2.411 . . . . 0.0 104.583 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 9.4 mt -52.86 16.0 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.84 -36.61 15.93 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 119.739 -1.851 . . . . 0.0 112.459 -178.904 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.427 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -158.83 140.1 13.13 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 119.562 -1.961 . . . . 0.0 114.822 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.664 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.1 tp -137.94 169.51 17.66 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.435 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.2 m-20 -148.0 130.79 16.06 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.285 -0.884 . . . . 0.0 109.041 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.886 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 0.6 OUTLIER -52.13 -17.2 0.99 Allowed 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.432 -0.793 . . . . 0.0 109.606 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.39 -20.6 51.54 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.24 27.59 4.13 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.85 108.78 19.91 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.589 1.185 . . . . 0.0 109.979 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.506 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.51 168.22 9.64 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.72 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.431 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.95 157.29 40.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.707 -1.246 . . . . 0.0 110.693 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.542 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 3.2 tp60 -155.25 145.96 22.28 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.476 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.2 OUTLIER 45.0 23.66 0.09 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.09 -1.006 . . . . 0.0 109.97 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 83.43 -6.48 1.17 Allowed 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.828 -0.545 . . . . 0.0 110.869 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -88.0 118.68 69.92 Favored Pre-proline 0 C--N 1.294 -1.816 0 O-C-N 121.279 -0.888 . . . . 0.0 109.559 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.513 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 37.0 Cg_exo -49.41 165.58 0.24 Allowed 'Trans proline' 0 N--CA 1.489 1.209 0 CA-C-N 120.089 1.067 . . . . 0.0 111.808 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.513 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.9 m-85 -170.82 137.66 1.29 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.133 -0.979 . . . . 0.0 110.473 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 28.5 m -70.36 155.63 40.41 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 104.247 -2.501 . . . . 0.0 104.247 174.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -59.11 -57.55 12.55 Favored 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 117.563 -1.655 . . . . 0.0 107.001 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -29.77 1.42 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 89.9 m -80.04 -65.62 0.98 Allowed 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.288 -0.882 . . . . 0.0 108.791 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.578 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.68 -55.86 17.02 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.751 -0.593 . . . . 0.0 110.048 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.692 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -47.06 -39.08 12.22 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.296 -0.877 . . . . 0.0 108.792 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt -67.91 -20.38 65.08 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.57 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 9.6 mt -90.66 -56.84 3.04 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.542 -1.349 . . . . 0.0 111.937 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.542 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 6.2 m-85 -91.61 -29.24 17.02 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.672 -1.268 . . . . 0.0 110.351 -178.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.422 ' O ' HD12 ' B' ' 601' ' ' LEU . 74.2 m . . . . . 0 N--CA 1.501 2.091 0 CA-C-O 118.062 -0.971 . . . . 0.0 109.448 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.5 ttm . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.3 -54.03 0.12 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.119 -0.988 . . . . 0.0 108.78 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.485 ' C ' ' N ' ' A' ' 5' ' ' GLY . 2.3 mp -45.77 -80.3 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.844 0.831 . . . . 0.0 110.426 179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' CG ' ' O ' ' A' ' 4' ' ' ASP . 19.4 t70 49.6 18.1 0.28 Allowed 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -178.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.485 ' N ' ' C ' ' A' ' 3' ' ' LEU . . . -70.95 -8.46 64.37 Favored Glycine 0 N--CA 1.486 2.014 0 N-CA-C 108.443 -1.863 . . . . 0.0 108.443 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.626 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -114.74 -105.09 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -178.817 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.51 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -151.76 -96.38 0.06 Allowed 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.594 -1.316 . . . . 0.0 109.882 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.546 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -142.13 -61.78 0.02 OUTLIER Pre-proline 0 N--CA 1.501 2.108 0 O-C-N 121.026 -1.046 . . . . 0.0 110.468 -179.503 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -44.8 -29.63 3.71 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 CA-C-N 121.329 1.51 . . . . 0.0 109.786 178.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -119.59 -23.67 6.5 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.194 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.84 -1.37 76.91 Favored Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.546 ' N ' ' O ' ' A' ' 8' ' ' MET . 30.1 t -169.43 -7.85 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.154 -1.204 . . . . 0.0 111.248 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.665 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 14.2 m-85 68.78 -80.01 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.222 -0.923 . . . . 0.0 108.885 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.665 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 166.21 -39.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.458 -0.776 . . . . 0.0 109.144 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -140.91 -0.57 1.48 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.462 -0.773 . . . . 0.0 109.577 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 88.52 31.86 12.64 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -85.46 122.83 30.16 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.435 -1.038 . . . . 0.0 109.274 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.417 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -131.79 123.15 27.02 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 179.258 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.14 129.82 35.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.982 . . . . 0.0 108.592 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.504 HD21 HG22 ' A' ' 84' ' ' ILE . 0.1 OUTLIER -83.31 131.57 35.07 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -77.85 145.63 36.17 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.444 -0.903 . . . . 0.0 109.296 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.1 t -138.93 113.53 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-O 121.868 0.842 . . . . 0.0 109.909 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.451 ' CG ' ' OD1' ' A' ' 30' ' ' ASP . 2.8 m80 -85.83 103.5 14.64 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.525 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -72.44 99.3 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 27' ' ' LEU . 59.2 p -73.67 -38.3 64.99 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.533 -0.729 . . . . 0.0 109.968 -178.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.41 18.16 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.061 -1.024 . . . . 0.0 108.627 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.9 mt -152.03 -30.53 0.16 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 24' ' ' VAL . 23.7 t-20 84.7 13.61 0.24 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 122.248 -0.282 . . . . 0.0 110.351 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -98.42 -178.2 3.94 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 120.954 -1.091 . . . . 0.0 109.952 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.451 ' OD1' ' CG ' ' A' ' 23' ' ' HIS . 32.1 m-20 -138.97 117.57 12.16 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.41 HG12 ' N ' ' A' ' 32' ' ' THR . 20.9 t -117.97 157.3 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-O 121.629 0.728 . . . . 0.0 110.096 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.443 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.79 135.33 43.79 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 179.686 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.538 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 2.4 mm? -116.51 112.29 21.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.566 -0.709 . . . . 0.0 109.336 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -60.66 103.92 0.3 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.414 ' HB ' HG11 ' A' ' 39' ' ' VAL . 22.1 m -136.28 -170.64 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.972 0.891 . . . . 0.0 110.338 -178.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.417 ' OG1' ' CG ' ' A' ' 38' ' ' GLU . 5.6 p -143.06 176.3 9.2 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.6 45.72 2.94 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' C ' HG21 ' A' ' 78' ' ' THR . 3.2 pt-20 -144.97 -0.13 0.92 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.295 -1.121 . . . . 0.0 108.605 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.455 ' O ' HG22 ' A' ' 78' ' ' THR . 1.7 m -87.89 134.11 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 121.006 -1.059 . . . . 0.0 109.81 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 m-70 -69.61 139.41 53.62 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 121.1 -1.0 . . . . 0.0 108.823 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.436 ' C ' ' N ' ' A' ' 43' ' ' GLY . 14.7 mt -47.31 -58.55 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.0 109.322 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.454 ' H ' HG22 ' A' ' 75' ' ' THR . . . -55.51 -13.19 5.38 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 108.219 -1.952 . . . . 0.0 108.219 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.84 -24.95 73.02 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 6.4 t -83.67 -38.5 14.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.482 ' O ' HG23 ' A' ' 49' ' ' VAL . 31.6 mtm -48.41 -37.39 16.88 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.426 ' CD1' HD13 ' B' ' 603' ' ' LEU . 2.1 tp -73.57 -61.27 1.89 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.738 -0.602 . . . . 0.0 110.788 -178.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -53.49 -61.27 2.41 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.214 -0.929 . . . . 0.0 110.889 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.6 tp -49.74 -35.06 20.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.277 -0.889 . . . . 0.0 109.416 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 45' ' ' MET . 9.2 t -73.02 -48.6 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.33 -0.856 . . . . 0.0 108.767 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -44.71 -37.44 3.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.536 -0.727 . . . . 0.0 109.559 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.538 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 55.5 mttp -71.16 -34.75 71.27 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.449 -0.782 . . . . 0.0 110.355 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.46 HD12 ' CG1' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.73 -63.24 1.33 Allowed 'General case' 0 C--N 1.306 -1.283 0 O-C-N 120.953 -1.092 . . . . 0.0 109.062 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 t70 69.54 78.3 0.21 Allowed 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.884 0.85 . . . . 0.0 109.895 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.553 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -171.51 147.42 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 C-N-CA 119.951 -0.699 . . . . 0.0 110.391 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -68.96 35.37 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.444 -0.785 . . . . 0.0 108.959 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.553 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.4 ttmm -78.34 154.64 30.65 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.12 -0.988 . . . . 0.0 108.817 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.22 97.75 0.75 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 108.767 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.541 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 45.7 m0 -80.45 -45.19 18.01 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.809 -0.557 . . . . 0.0 110.095 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.2 t -56.39 -56.61 19.03 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.995 -1.066 . . . . 0.0 110.399 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.426 ' OD1' ' O ' ' A' ' 94' ' ' PRO . 16.3 t70 -49.83 -24.63 2.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.16 -0.963 . . . . 0.0 108.881 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.541 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -73.36 148.17 43.66 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.961 0.886 . . . . 0.0 109.731 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -160.68 152.6 19.94 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.826 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -94.79 143.06 26.76 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.141 -0.975 . . . . 0.0 109.716 -179.088 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.531 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.23 137.4 52.88 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.5 t90 -95.77 89.78 5.42 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.589 -0.694 . . . . 0.0 109.425 -179.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.477 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 14.4 pt-20 -53.98 -23.78 14.39 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.176 -0.952 . . . . 0.0 110.298 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.497 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.5 mmtp -63.91 -10.8 22.95 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.471 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -134.95 -12.3 2.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.212 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.6 44.95 29.07 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -110.03 -174.15 2.42 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.515 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.92 99.6 5.58 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 177.529 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.6 mt -59.88 83.75 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.053 0 CA-C-O 122.361 1.077 . . . . 0.0 110.662 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.5 6.69 10.07 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.133 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.444 ' CB ' ' NZ ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.73 74.04 5.27 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.21 -0.931 . . . . 0.0 109.542 -179.472 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.562 HG21 ' O ' ' B' ' 602' ' ' LYS . 11.8 p -75.93 -18.55 59.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.285 -0.884 . . . . 0.0 109.882 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -76.76 36.54 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.117 -0.989 . . . . 0.0 110.25 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -175.57 -143.81 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -152.96 149.53 28.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.851 -1.781 . . . . 0.0 109.506 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.681 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.3 pt? -40.2 -48.63 2.59 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.196 -0.94 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.423 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 18.0 t70 -47.23 -33.46 5.47 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.171 -0.956 . . . . 0.0 109.574 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.563 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.73 -31.08 70.77 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.563 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -79.02 -50.93 10.3 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 178.629 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.1 9.39 6.13 Favored Glycine 0 N--CA 1.509 3.562 0 N-CA-C 108.898 -1.681 . . . . 0.0 108.898 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.504 HG22 HD21 ' A' ' 20' ' ' LEU . 56.4 mt -60.63 161.35 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -164.47 -168.68 1.57 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.255 -0.903 . . . . 0.0 109.074 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.34 -23.04 65.58 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.284 -0.885 . . . . 0.0 110.157 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -2.24 56.99 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.196 -0.94 . . . . 0.0 108.908 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.481 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.37 113.03 25.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.527 -0.733 . . . . 0.0 109.641 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp -98.32 115.55 28.67 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.995 -1.066 . . . . 0.0 109.741 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.7 mt -95.38 176.11 6.32 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -133.58 156.63 47.48 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.538 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 2.2 t80 -115.21 126.4 54.51 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.19 159.06 26.71 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 120.992 -1.068 . . . . 0.0 110.274 -178.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.426 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 9.6 Cg_endo . . . . . 0 N--CA 1.497 1.694 0 C-N-CA 122.789 2.326 . . . . 0.0 111.735 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 541' ' ' TYR . . . . . 0.449 ' O ' ' CD1' ' B' ' 541' ' ' TYR . 58.7 t80 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -63.86 -152.94 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.304 -0.872 . . . . 0.0 109.587 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.409 ' HG3' HH21 ' B' ' 544' ' ' ARG . 0.1 OUTLIER -163.83 -80.99 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 109.295 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.409 HH21 ' HG3' ' B' ' 543' ' ' GLU . 10.5 mpt_? 38.84 32.02 0.05 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.726 -0.609 . . . . 0.0 110.616 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.526 ' HD2' ' H ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -52.84 -76.24 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.262 -0.899 . . . . 0.0 108.773 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -167.07 -99.08 0.13 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.536 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m -169.56 118.22 0.63 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -58.15 135.67 57.1 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.893 -1.129 . . . . 0.0 110.375 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.53 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.01 104.12 13.82 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 178.467 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.52 125.4 11.24 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 122.077 0.941 . . . . 0.0 109.695 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -33.86 5.83 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 106.569 -2.612 . . . . 0.0 106.569 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.1 m -106.3 -35.52 7.13 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 54.97 56.65 6.38 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.793 1.283 . . . . 0.0 109.937 -178.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -140.66 123.77 10.04 Favored Pre-proline 0 C--N 1.295 -1.78 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -44.1 134.03 8.57 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 CA-C-N 120.461 1.2 . . . . 0.0 114.674 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.536 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.2 mt -92.65 98.37 8.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.9 p -99.71 91.16 4.73 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.301 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.1 -96.01 0.15 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.433 -2.267 . . . . 0.0 107.433 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -113.2 150.9 31.66 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.53 126.48 15.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.0 -1.062 . . . . 0.0 111.384 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.3 mt -90.57 146.21 6.47 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.3 m -121.21 146.4 46.84 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-O 121.982 0.896 . . . . 0.0 108.968 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.734 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -124.56 -127.9 0.25 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-O 122.092 0.949 . . . . 0.0 108.783 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 0.0 OUTLIER -65.51 28.1 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.734 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 103.43 -8.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 149.64 26.75 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -95.69 174.86 6.77 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -160.36 134.02 6.99 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 118.289 -1.365 . . . . 0.0 110.077 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.59 ' O ' ' N ' ' B' ' 571' ' ' GLU . 6.0 m80 -55.65 115.84 10.49 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 177.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.44 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 53.0 Cg_exo -45.32 -9.5 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.43 0 CA-C-N 120.298 1.142 . . . . 0.0 112.141 -178.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.931 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.3 mt-10 -102.03 -52.55 3.14 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 122.059 0.933 . . . . 0.0 109.978 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.452 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 16.7 m170 -56.88 -3.96 0.14 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.862 -1.149 . . . . 0.0 109.992 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.464 ' H ' ' C ' ' B' ' 571' ' ' GLU . 20.6 t80 -126.6 55.6 1.52 Allowed 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.931 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.1 m -94.25 177.68 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-O 121.711 0.767 . . . . 0.0 110.818 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.579 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.62 145.06 33.27 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.228 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.45 74.21 3.28 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 116.621 -2.031 . . . . 0.0 109.03 178.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.34 -47.45 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 102.87 -3.011 . . . . 0.0 102.87 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.572 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.6 p -132.95 81.28 1.93 Allowed 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.282 -2.236 . . . . 0.0 104.975 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 1.074 HD13 ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.67 15.5 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -176.459 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.09 -36.95 17.83 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 119.474 -2.016 . . . . 0.0 112.69 -178.302 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.402 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -160.36 140.1 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 119.416 -2.052 . . . . 0.0 114.969 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.579 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.6 tp -139.53 169.3 18.0 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.455 ' O ' ' N ' ' B' ' 587' ' ' PHE . 71.8 m-20 -145.62 130.55 18.23 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.159 -0.963 . . . . 0.0 108.864 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -52.44 -21.38 3.62 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.433 -0.792 . . . . 0.0 109.577 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.2 -16.35 60.94 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.6 p -134.66 26.27 3.7 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.906 -0.761 . . . . 0.0 108.971 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -88.64 109.69 20.32 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 122.443 1.116 . . . . 0.0 109.484 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.46 162.55 12.96 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.2 tt0 -153.83 156.89 38.48 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.558 1.17 . . . . 0.0 111.026 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.483 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 4.4 tt0 -156.46 141.52 17.25 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 105.985 -1.857 . . . . 0.0 105.985 178.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.55 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.95 25.81 3.32 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 120.846 -1.159 . . . . 0.0 109.288 178.925 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.8 m-20 79.85 -7.7 1.64 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.708 -0.62 . . . . 0.0 111.365 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 593' ' ' LYS . . . . . 0.458 ' O ' ' CE2' ' B' ' 595' ' ' TYR . 15.9 mttt -86.99 115.69 63.47 Favored Pre-proline 0 C--N 1.295 -1.791 0 O-C-N 121.153 -0.967 . . . . 0.0 110.282 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.597 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 32.7 Cg_exo -53.31 160.53 4.7 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 CA-C-N 119.969 1.025 . . . . 0.0 111.979 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.597 ' CD1' ' O ' ' B' ' 594' ' ' PRO . 51.8 m-85 -168.19 135.59 2.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.623 -0.673 . . . . 0.0 110.167 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.7 m -65.53 154.97 37.12 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 175.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -60.73 -57.35 13.06 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 178.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.09 -29.18 1.41 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 17.8 m -81.81 -61.18 1.99 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.537 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -56.59 -52.26 65.51 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.207 0.527 . . . . 0.0 110.133 -179.546 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.687 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -50.95 -43.33 60.26 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.055 -1.028 . . . . 0.0 109.072 -178.825 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.562 ' O ' HG21 ' A' ' 75' ' ' THR . 0.6 OUTLIER -55.59 -21.2 16.34 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.558 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.426 HD13 ' CD1' ' A' ' 46' ' ' LEU . 1.7 mt -94.24 -56.41 2.85 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.86 -1.15 . . . . 0.0 111.111 -178.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.487 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 23.9 m-85 -94.91 5.5 51.73 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.934 -1.104 . . . . 0.0 110.11 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.487 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 20.0 m . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.958 -1.089 . . . . 0.0 109.41 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.8 ttt . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.53 ' O ' ' N ' ' A' ' 4' ' ' ASP . . . -160.72 -48.35 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.886 -1.134 . . . . 0.0 109.318 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.479 ' C ' ' O ' ' A' ' 2' ' ' ALA . 20.1 mt 23.6 -85.74 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.728 0.775 . . . . 0.0 112.056 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 2' ' ' ALA . 11.8 t0 51.56 18.56 0.71 Allowed 'General case' 0 C--N 1.3 -1.553 0 CA-C-O 122.253 1.025 . . . . 0.0 108.314 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.444 ' N ' ' C ' ' A' ' 3' ' ' LEU . . . -69.87 -7.98 60.05 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 108.375 -1.89 . . . . 0.0 108.375 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.523 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -112.92 -111.45 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -178.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.473 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -159.22 -94.14 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 O-C-N 120.335 -1.478 . . . . 0.0 110.398 -179.848 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.578 ' O ' ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -131.35 -54.86 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.547 0 O-C-N 121.022 -1.049 . . . . 0.0 111.786 -178.86 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -48.95 -19.62 2.42 Favored 'Trans proline' 0 N--CA 1.489 1.238 0 CA-C-N 120.916 1.363 . . . . 0.0 109.486 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.435 ' N ' ' C ' ' A' ' 8' ' ' MET . 10.1 t70 -142.21 -18.14 0.72 Allowed 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.882 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.99 -14.32 49.55 Favored Glycine 0 N--CA 1.493 2.45 0 O-C-N 121.025 -1.047 . . . . 0.0 111.299 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.539 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 2.8 t -173.94 -34.08 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.612 -1.522 . . . . 0.0 111.266 -179.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.671 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 4.7 t80 86.38 -43.53 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 160.45 -47.96 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -153.38 7.1 0.37 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.96 14.09 75.97 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.9 p -91.09 122.84 34.07 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.714 -0.874 . . . . 0.0 109.987 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -129.66 121.49 27.09 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.613 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.84 128.93 35.51 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.247 -0.908 . . . . 0.0 108.875 -179.664 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.546 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -83.67 132.3 34.89 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.411 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.56 145.71 34.67 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.726 -0.79 . . . . 0.0 110.22 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.9 t -135.4 103.97 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 CA-C-O 121.586 0.707 . . . . 0.0 109.49 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -78.05 104.48 8.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 178.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.547 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.4 t -69.83 108.77 2.21 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.003 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.8 p -77.42 162.86 26.89 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.4 t0 73.16 -43.74 0.57 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.49 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.4 mt -92.73 -36.67 12.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' VAL . 25.7 t-20 78.53 18.17 1.02 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.868 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -93.04 -178.94 4.95 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.834 -1.166 . . . . 0.0 109.436 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -137.93 113.87 9.9 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.2 t -110.58 152.37 12.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 CA-C-O 121.59 0.71 . . . . 0.0 109.45 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.448 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.82 130.52 38.05 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.448 HD22 ' C ' ' A' ' 32' ' ' THR . 2.9 mm? -114.22 112.98 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.687 -0.633 . . . . 0.0 109.39 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -59.79 105.63 0.4 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 m -135.37 -170.39 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 CA-C-O 121.812 0.815 . . . . 0.0 110.13 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 p -142.12 175.03 10.06 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.61 47.87 3.1 Favored Glycine 0 N--CA 1.483 1.799 0 N-CA-C 109.068 -1.613 . . . . 0.0 109.068 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.437 ' C ' HG21 ' A' ' 78' ' ' THR . 0.0 OUTLIER -147.38 -3.57 0.55 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.482 -1.01 . . . . 0.0 108.998 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 m -86.55 128.28 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.062 -1.024 . . . . 0.0 110.081 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 43' ' ' GLY . 5.6 m-70 -63.36 149.76 45.04 Favored 'General case' 0 C--N 1.29 -1.992 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.985 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.446 ' C ' ' N ' ' A' ' 43' ' ' GLY . 25.4 mt -49.64 -54.69 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.972 -1.08 . . . . 0.0 108.523 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.653 ' H ' HG23 ' A' ' 75' ' ' THR . . . -56.06 -12.2 5.34 Favored Glycine 0 C--N 1.299 -1.526 0 N-CA-C 108.139 -1.984 . . . . 0.0 108.139 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -65.69 -27.46 72.68 Favored Glycine 0 N--CA 1.482 1.703 0 N-CA-C 107.357 -2.297 . . . . 0.0 107.357 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -83.68 -44.81 18.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 34.1 mtm -46.96 -37.16 8.61 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -67.48 -65.67 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.347 0.594 . . . . 0.0 110.57 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -53.36 -53.38 51.9 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.391 -0.818 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -45.54 -59.24 2.83 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.723 -1.236 . . . . 0.0 109.687 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.726 HG22 ' CD2' ' A' ' 58' ' ' TRP . 85.1 t -54.25 -51.45 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.849 -1.157 . . . . 0.0 109.749 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -44.79 -40.22 5.92 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.355 -0.841 . . . . 0.0 110.145 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -68.21 -57.57 5.81 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.157 -0.964 . . . . 0.0 111.275 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.406 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.9 OUTLIER -62.11 -66.33 0.56 Allowed 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.82 -1.175 . . . . 0.0 109.014 -179.162 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.0 t70 72.38 82.54 0.14 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.928 0.871 . . . . 0.0 109.914 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.522 ' C ' ' H ' ' A' ' 56' ' ' LYS . 1.7 p -167.05 150.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.146 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.815 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -68.36 35.02 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.499 -0.75 . . . . 0.0 110.139 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.522 ' H ' ' C ' ' A' ' 54' ' ' VAL . 3.2 ttpm? -81.78 155.56 25.38 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.082 -1.011 . . . . 0.0 109.512 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -49.66 112.43 0.65 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.274 -0.891 . . . . 0.0 109.649 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.726 ' CD2' HG22 ' A' ' 49' ' ' VAL . 30.1 m95 -125.09 -30.31 3.22 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.562 -0.711 . . . . 0.0 110.045 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -56.6 13.72 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 120.914 -1.116 . . . . 0.0 110.797 -178.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.43 ' O ' ' O ' ' A' ' 94' ' ' PRO . 15.1 t0 -69.4 -4.0 16.62 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.106 -0.997 . . . . 0.0 110.396 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.99 153.62 40.85 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.133 0.968 . . . . 0.0 110.676 -179.004 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -167.87 155.52 8.57 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.832 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.6 mm? -93.73 148.42 22.13 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.893 -1.13 . . . . 0.0 109.708 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.543 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.48 148.68 50.31 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.023 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.548 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -107.96 91.45 3.65 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.073 -1.017 . . . . 0.0 108.43 -178.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -55.23 -22.53 18.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.122 -0.986 . . . . 0.0 111.203 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.482 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -65.18 -18.61 65.45 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.177 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -123.95 -13.07 7.43 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.428 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.548 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.54 46.29 26.41 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 -177.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 t -113.49 -172.5 2.08 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.473 0.654 . . . . 0.0 109.851 -178.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.475 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.64 104.38 8.35 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 177.672 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.446 ' HB3' HD13 ' A' ' 41' ' ' ILE . 46.2 mt -62.86 83.95 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.256 0 O-C-N 120.474 -1.391 . . . . 0.0 110.995 -176.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.475 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -119.02 6.73 11.32 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.482 ' O ' ' N ' ' A' ' 76' ' ' HIS . 5.9 mmpt? -76.36 32.76 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.653 HG23 ' H ' ' A' ' 42' ' ' GLY . 7.2 m -50.52 -10.08 0.06 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.102 -0.999 . . . . 0.0 109.661 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.482 ' N ' ' O ' ' A' ' 74' ' ' LYS . 21.4 t-80 -53.47 -65.93 0.48 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.233 -0.917 . . . . 0.0 109.265 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -85.73 -143.16 0.1 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.638 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -130.47 169.67 15.22 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.661 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -60.19 -50.34 74.04 Favored 'General case' 0 C--N 1.287 -2.142 0 O-C-N 121.327 -0.858 . . . . 0.0 109.952 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.453 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 19.9 t70 -43.89 -35.89 2.17 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-O 122.19 0.995 . . . . 0.0 109.124 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.638 ' CG ' ' H ' ' A' ' 78' ' ' THR . 44.5 mmtt -65.12 -51.35 61.76 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -44.89 95.71 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 115.14 37.29 1.13 Allowed Glycine 0 N--CA 1.511 3.695 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.404 HG22 HD21 ' A' ' 20' ' ' LEU . 56.8 mt -92.96 161.98 2.46 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -165.01 -166.03 0.97 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.259 -0.9 . . . . 0.0 109.465 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.92 -22.08 64.18 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.461 -0.774 . . . . 0.0 109.784 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -5.48 58.15 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.31 -0.869 . . . . 0.0 108.779 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.33 112.44 24.62 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.537 -0.727 . . . . 0.0 109.196 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -97.2 115.4 27.52 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.996 -1.065 . . . . 0.0 109.61 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.546 ' HG ' HD12 ' A' ' 20' ' ' LEU . 7.1 mt -93.42 176.18 6.48 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.543 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.0 mt-30 -135.19 157.15 47.66 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.476 ' CD2' ' C ' ' A' ' 92' ' ' PHE . 0.6 OUTLIER -105.76 131.86 52.6 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.365 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.8 151.86 50.69 Favored Pre-proline 0 N--CA 1.5 2.052 0 O-C-N 120.95 -1.094 . . . . 0.0 109.196 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' A' ' 60' ' ' ASP . 74.3 Cg_endo . . . . . 0 N--CA 1.495 1.603 0 C-N-CA 122.375 2.05 . . . . 0.0 111.65 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -68.94 -101.81 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.232 -0.917 . . . . 0.0 109.488 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.484 ' O ' ' N ' ' B' ' 545' ' ' ARG . 2.1 pp20? -140.57 -0.44 1.56 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.284 -0.885 . . . . 0.0 109.637 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.467 ' CG ' HH21 ' B' ' 544' ' ' ARG . 0.0 OUTLIER -66.34 68.44 0.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.196 -0.94 . . . . 0.0 109.457 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.517 ' HG2' HH21 ' B' ' 545' ' ' ARG . 0.3 OUTLIER -83.08 -148.06 0.09 Allowed 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.264 -0.898 . . . . 0.0 109.382 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -159.95 -98.76 0.14 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.6 m -171.89 120.42 0.45 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.333 -1.098 . . . . 0.0 108.113 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.68 134.68 57.32 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.808 -1.183 . . . . 0.0 110.216 -178.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.498 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.37 104.03 13.21 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.6 t -50.88 127.03 17.55 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 122.174 0.988 . . . . 0.0 109.668 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.59 -34.65 5.35 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 106.081 -2.807 . . . . 0.0 106.081 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -105.58 -35.94 7.27 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.07 56.39 6.61 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.73 1.252 . . . . 0.0 109.914 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -140.57 123.7 10.09 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -44.31 134.83 9.0 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 CA-C-N 120.446 1.195 . . . . 0.0 114.633 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.1 mt -93.9 98.41 8.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 557' ' ' THR . . . . . 0.409 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -99.54 91.26 4.82 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.258 -0.901 . . . . 0.0 111.208 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.46 -96.12 0.15 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 107.396 -2.282 . . . . 0.0 107.396 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.472 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.15 151.15 31.23 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.5 p -144.55 126.28 15.2 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.462 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.85 146.62 5.98 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.579 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 8.3 m -117.93 146.77 43.73 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.743 0.782 . . . . 0.0 109.041 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.51 -129.36 0.26 Allowed 'General case' 0 C--N 1.294 -1.814 0 CA-C-O 121.598 0.713 . . . . 0.0 109.228 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 4.0 mtt -65.84 26.27 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.33 -9.11 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -81.75 162.58 22.89 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.63 174.97 5.65 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.213 -1.402 . . . . 0.0 107.213 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.99 133.7 6.22 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 117.986 -1.486 . . . . 0.0 110.257 -178.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.594 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.7 m80 -54.32 115.17 7.88 Favored Pre-proline 0 C--N 1.304 -1.393 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 177.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.436 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 50.1 Cg_exo -45.38 -8.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 CA-C-N 120.278 1.135 . . . . 0.0 112.412 -178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.729 ' O ' HG13 ' B' ' 574' ' ' VAL . 8.5 mt-10 -104.11 -53.12 2.8 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 122.154 0.978 . . . . 0.0 109.757 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.449 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.6 m170 -54.73 -5.55 0.09 Allowed 'General case' 0 C--N 1.293 -1.86 0 O-C-N 120.431 -1.418 . . . . 0.0 109.734 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.491 ' H ' ' C ' ' B' ' 571' ' ' GLU . 15.9 t80 -125.45 53.46 1.54 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.729 HG13 ' O ' ' B' ' 571' ' ' GLU . 12.5 m -93.5 176.75 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.622 -0.674 . . . . 0.0 109.94 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.591 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.12 142.03 36.77 Favored 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.14 74.83 4.04 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 116.58 -2.048 . . . . 0.0 109.774 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.96 -57.87 0.15 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 101.655 -3.461 . . . . 0.0 101.655 172.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.552 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.1 p -122.39 78.48 1.51 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 111.922 -2.399 . . . . 0.0 104.738 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 0.631 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.8 mp -52.01 16.3 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -176.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.552 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.37 -37.42 21.56 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 119.476 -2.015 . . . . 0.0 112.328 -178.406 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.477 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.6 tp-100 -161.32 143.39 11.97 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 119.474 -2.016 . . . . 0.0 114.199 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.591 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.7 tp -138.95 170.69 15.53 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.452 ' O ' ' N ' ' B' ' 587' ' ' PHE . 69.0 m-20 -146.56 137.87 24.37 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.263 -0.898 . . . . 0.0 109.394 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.579 ' CE ' ' H ' ' B' ' 562' ' ' THR . 6.1 ptpp? -55.29 -22.43 18.67 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.582 0.706 . . . . 0.0 110.09 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.05 -17.06 59.96 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -131.18 23.56 4.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.967 -0.725 . . . . 0.0 109.344 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.538 ' O ' ' CG ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.7 113.02 25.0 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 122.235 1.017 . . . . 0.0 109.341 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -107.25 165.0 11.7 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 179.022 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.45 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.4 tt0 -152.13 156.99 40.93 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.719 1.247 . . . . 0.0 110.47 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.642 ' NE2' ' CE2' ' B' ' 600' ' ' PHE . 0.0 OUTLIER -160.96 146.55 14.44 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.456 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 48.37 22.82 0.5 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.749 -1.219 . . . . 0.0 109.425 -178.718 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.0 m-20 79.91 -6.38 1.77 Allowed 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.636 -0.665 . . . . 0.0 111.448 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 593' ' ' LYS . . . . . 0.52 ' O ' ' CE1' ' B' ' 595' ' ' TYR . 33.3 mttm -88.96 115.89 64.8 Favored Pre-proline 0 C--N 1.294 -1.832 0 O-C-N 121.064 -1.022 . . . . 0.0 110.121 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.562 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.0 Cg_exo -51.54 163.14 1.23 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 119.998 1.035 . . . . 0.0 112.369 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.562 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 66.4 m-85 -169.78 142.31 2.44 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.449 -0.782 . . . . 0.0 110.099 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 5.9 m -67.42 154.86 40.38 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -59.07 -58.01 10.54 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -48.29 -24.96 1.35 Allowed 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.629 -0.669 . . . . 0.0 110.025 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 599' ' ' CYS . . . . . 0.413 ' O ' ' HG ' ' B' ' 603' ' ' LEU . 1.4 m -77.08 -65.69 0.92 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.23 -0.919 . . . . 0.0 110.432 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.642 ' CE2' ' NE2' ' B' ' 590' ' ' GLN . 2.1 t80 -70.81 -40.49 72.45 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.848 -1.157 . . . . 0.0 111.261 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.687 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -52.11 -42.94 63.68 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.455 ' O ' HG21 ' A' ' 75' ' ' THR . 18.9 tptm -54.84 -25.33 27.83 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' B' ' 600' ' ' PHE . 11.6 mt -95.29 -57.95 2.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.477 -0.764 . . . . 0.0 111.652 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.494 ' CD1' ' CE2' ' B' ' 600' ' ' PHE . 13.0 m-85 -100.81 32.62 3.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.97 -1.082 . . . . 0.0 110.268 -179.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 109.698 179.526 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ttm . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.433 ' O ' ' O ' ' A' ' 7' ' ' ARG . . . -147.79 -55.81 0.23 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.992 -1.067 . . . . 0.0 108.803 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.586 ' C ' ' H ' ' A' ' 5' ' ' GLY . 57.7 mt -43.92 -80.0 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.916 0.865 . . . . 0.0 109.694 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.535 ' OD1' HD11 ' A' ' 6' ' ' ILE . 9.1 t0 61.43 -6.88 0.11 Allowed 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.725 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.586 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 115.84 -12.0 17.89 Favored Glycine 0 N--CA 1.493 2.45 0 N-CA-C 108.359 -1.896 . . . . 0.0 108.359 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.623 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -116.71 -106.4 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -178.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.5 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -153.95 -97.83 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 120.623 -1.298 . . . . 0.0 109.922 -179.203 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.565 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -140.58 -61.2 0.02 OUTLIER Pre-proline 0 N--CA 1.503 2.191 0 O-C-N 120.993 -1.067 . . . . 0.0 110.162 -179.595 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.441 ' O ' ' O ' ' A' ' 13' ' ' TYR . 65.4 Cg_exo -44.9 -35.18 9.62 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 CA-C-N 121.119 1.436 . . . . 0.0 109.911 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -111.67 -25.15 9.67 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.03 9.41 74.75 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.565 ' N ' ' O ' ' A' ' 8' ' ' MET . 51.8 t -156.62 -70.61 0.1 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.266 -1.138 . . . . 0.0 110.631 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.457 ' CG ' ' O ' ' A' ' 12' ' ' CYS . 24.5 m-85 -162.31 -86.39 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.991 -1.068 . . . . 0.0 109.591 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -174.08 -36.49 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -152.17 8.14 0.47 Allowed 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.88 11.34 85.31 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 108.506 -1.838 . . . . 0.0 108.506 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 17' ' ' THR . 4.8 t -103.57 122.43 44.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.752 -0.852 . . . . 0.0 109.736 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.512 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -119.2 128.19 53.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.11 136.19 36.48 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.375 -0.828 . . . . 0.0 110.074 -179.392 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.492 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.45 132.78 34.16 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.319 -1.364 . . . . 0.0 107.319 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.96 145.49 36.03 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.788 -1.195 . . . . 0.0 108.234 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.9 t -140.46 115.96 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.719 0.771 . . . . 0.0 110.303 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -88.6 103.69 16.15 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.574 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -68.96 108.31 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.527 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.3 p -75.62 -55.94 5.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.274 -0.891 . . . . 0.0 110.566 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.546 ' CB ' ' NE2' ' A' ' 61' ' ' HIS . 25.6 t0 -58.24 1.06 0.06 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.039 -1.038 . . . . 0.0 109.824 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.6 mt -134.51 -25.09 1.52 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.341 -0.849 . . . . 0.0 109.433 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 24' ' ' VAL . 28.4 t-20 76.14 14.26 2.53 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.923 -0.486 . . . . 0.0 110.199 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -94.04 -178.07 4.52 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.871 -1.143 . . . . 0.0 109.836 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -136.76 119.12 15.71 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.448 HG12 ' N ' ' A' ' 32' ' ' THR . 23.1 t -122.54 157.8 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-O 121.658 0.742 . . . . 0.0 110.065 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.493 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.07 133.42 42.97 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -179.976 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.493 HD22 ' C ' ' A' ' 32' ' ' THR . 3.9 mm? -115.27 113.12 23.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.618 -0.676 . . . . 0.0 110.151 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.445 ' CA ' ' HE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -58.52 114.05 2.29 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.001 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.4 m -140.88 -170.2 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-O 121.967 0.889 . . . . 0.0 110.498 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.5 p -144.18 175.3 10.17 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.92 43.79 3.03 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.477 ' C ' HG21 ' A' ' 78' ' ' THR . 7.3 pt-20 -145.25 5.14 1.09 Allowed 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.573 ' O ' HG22 ' A' ' 78' ' ' THR . 2.6 m -89.97 136.81 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.015 -1.053 . . . . 0.0 109.993 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m-70 -75.31 141.87 43.33 Favored 'General case' 0 C--N 1.292 -1.924 0 O-C-N 120.96 -1.088 . . . . 0.0 108.232 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 32.3 mt -47.07 -57.99 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.001 -1.062 . . . . 0.0 109.654 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.554 ' H ' HG23 ' A' ' 75' ' ' THR . . . -54.05 -13.49 3.56 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 108.143 -1.983 . . . . 0.0 108.143 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.6 -28.89 64.52 Favored Glycine 0 N--CA 1.485 1.944 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.8 t -83.74 -39.01 14.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.458 ' O ' HG23 ' A' ' 49' ' ' VAL . 27.7 mtm -46.47 -39.88 11.43 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.623 HD12 HD13 ' B' ' 603' ' ' LEU . 0.4 OUTLIER -78.33 -58.1 3.43 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.52 -0.737 . . . . 0.0 110.535 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.41 ' CB ' HD12 ' A' ' 33' ' ' LEU . 39.0 mttm -47.89 -59.34 3.41 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.775 -1.203 . . . . 0.0 109.893 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 36.0 tp -45.75 -38.28 6.85 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.337 -0.852 . . . . 0.0 109.391 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 45' ' ' MET . 81.4 t -78.37 -42.39 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.155 -0.966 . . . . 0.0 109.403 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.429 ' O ' ' OD1' ' A' ' 53' ' ' ASP . 39.5 mm-40 -46.54 -39.92 11.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.272 -0.892 . . . . 0.0 109.276 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.485 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.0 mtmp? -74.78 -34.01 62.37 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.52 -69.02 0.51 Allowed 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 50' ' ' GLU . 91.2 m-20 52.8 68.09 0.89 Allowed 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.17 0.509 . . . . 0.0 109.725 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.618 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.7 OUTLIER -136.42 32.06 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 122.0 0.905 . . . . 0.0 109.927 -178.775 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.42 ' HG3' HD12 ' B' ' 579' ' ' LEU . 24.1 tptt 41.66 19.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.732 -0.605 . . . . 0.0 110.647 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.537 ' N ' ' O ' ' A' ' 54' ' ' VAL . 28.3 ttmt -75.65 151.37 37.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.826 -1.171 . . . . 0.0 107.939 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.46 ' OD1' ' N ' ' A' ' 57' ' ' ASP . 0.7 OUTLIER -53.59 89.78 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.405 -0.809 . . . . 0.0 108.925 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.528 ' N ' ' O ' ' A' ' 56' ' ' LYS . 10.7 m0 -78.3 -43.47 27.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.514 ' C ' ' H ' ' A' ' 61' ' ' HIS . 32.2 t -54.2 -48.69 70.72 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.609 -0.682 . . . . 0.0 109.249 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -59.59 -1.41 0.24 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.387 -0.82 . . . . 0.0 109.16 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.546 ' NE2' ' CB ' ' A' ' 26' ' ' ASP . 14.9 m80 -123.18 147.93 46.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.619 -0.676 . . . . 0.0 109.477 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.532 ' H ' ' C ' ' A' ' 93' ' ' THR . . . -156.38 179.35 9.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.384 -0.822 . . . . 0.0 108.828 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.721 HD22 ' N ' ' A' ' 63' ' ' LEU . 2.9 mm? -94.92 140.43 29.95 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.02 -1.05 . . . . 0.0 110.502 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.516 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -134.67 146.6 49.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.5 t90 -105.82 91.34 3.7 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.938 -1.101 . . . . 0.0 108.751 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 9.7 pt-20 -55.92 -22.52 26.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.968 . . . . 0.0 110.811 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -64.9 -18.09 64.9 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 178.07 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -125.45 -11.37 6.84 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.303 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.2 mpp_? 53.34 47.38 24.34 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 -178.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -115.14 -170.75 1.82 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.45 0.643 . . . . 0.0 110.033 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -124.28 99.83 6.41 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 177.081 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.0 86.5 0.01 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.676 -1.265 . . . . 0.0 110.895 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.1 pp -121.35 4.33 10.26 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.514 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -69.82 35.09 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.062 -1.024 . . . . 0.0 109.306 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.554 HG23 ' H ' ' A' ' 42' ' ' GLY . 21.8 m -51.73 -7.18 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.684 -1.26 . . . . 0.0 109.849 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.514 ' H ' ' C ' ' A' ' 74' ' ' LYS . 1.1 t60 -50.31 -73.14 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.183 -0.948 . . . . 0.0 110.2 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -90.64 -112.43 0.08 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.083 -1.011 . . . . 0.0 109.961 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -152.83 -163.39 1.7 Allowed 'General case' 0 N--CA 1.504 2.233 0 O-C-N 119.563 -1.961 . . . . 0.0 111.445 -178.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.597 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.8 mp -70.51 -57.27 4.94 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -42.68 -45.68 4.79 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.127 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.511 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -83.18 -47.94 11.04 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.38 7.17 12.56 Favored Glycine 0 N--CA 1.501 3.012 0 N-CA-C 108.547 -1.821 . . . . 0.0 108.547 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 36.9 mt -61.15 160.49 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.497 ' HA ' ' CZ3' ' A' ' 18' ' ' TRP . 1.0 OUTLIER -154.15 -164.42 1.85 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 108.986 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -75.25 -17.28 60.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.348 -0.845 . . . . 0.0 109.772 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.06 3.85 50.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.492 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.02 113.34 25.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.284 -0.885 . . . . 0.0 108.981 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -96.03 123.63 39.72 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.001 -1.062 . . . . 0.0 109.994 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.474 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.6 mt -106.46 177.94 4.71 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.771 0.795 . . . . 0.0 109.123 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.516 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 6.0 mt-30 -131.87 165.36 24.04 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -117.05 91.34 3.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.532 ' C ' ' H ' ' A' ' 62' ' ' ALA . 0.3 OUTLIER -146.21 161.74 37.88 Favored Pre-proline 0 N--CA 1.497 1.919 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -178.527 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.49 1.275 0 C-N-CA 122.385 2.056 . . . . 0.0 111.761 179.712 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 79.4 t80 . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -60.52 -171.98 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.325 -0.859 . . . . 0.0 109.796 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -107.59 -33.62 7.26 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.568 ' HD3' ' H ' ' B' ' 544' ' ' ARG . 0.0 OUTLIER -81.34 92.11 6.35 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.238 -0.914 . . . . 0.0 109.706 -179.824 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.462 ' CG ' HH21 ' B' ' 545' ' ' ARG . 0.0 OUTLIER -72.11 -158.19 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.215 -0.928 . . . . 0.0 109.421 179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -147.55 -99.15 0.22 Allowed Glycine 0 N--CA 1.495 2.581 0 N-CA-C 109.217 -1.553 . . . . 0.0 109.217 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m -159.5 116.64 2.65 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.67 135.58 57.68 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 120.949 -1.094 . . . . 0.0 110.259 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.517 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.38 103.5 12.79 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.41 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.3 t -50.22 126.1 13.99 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-O 122.153 0.978 . . . . 0.0 109.628 -177.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.17 5.6 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 106.304 -2.718 . . . . 0.0 106.304 -177.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.1 m -105.94 -35.82 7.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.16 56.22 6.74 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 122.658 1.218 . . . . 0.0 110.004 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp -140.79 124.21 10.13 Favored Pre-proline 0 C--N 1.293 -1.853 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -44.38 136.05 8.69 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.447 1.195 . . . . 0.0 114.612 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.0 mt -95.37 98.26 7.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.6 p -100.11 90.72 4.47 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.259 -0.901 . . . . 0.0 111.169 -177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.01 -95.87 0.15 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.405 -2.278 . . . . 0.0 107.405 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.458 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.5 mmt180 -113.15 149.52 33.48 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.34 126.36 15.47 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.984 -1.073 . . . . 0.0 111.455 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 561' ' ' ILE . . . . . 0.519 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 48.9 mt -91.14 146.86 5.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.691 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.9 m -117.28 146.96 42.98 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.766 0.793 . . . . 0.0 109.131 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.67 -129.3 0.26 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.551 0.691 . . . . 0.0 109.401 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.55 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.2 mtt -65.78 26.26 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.2 -8.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 -178.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -81.42 164.45 22.06 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -106.94 174.5 5.86 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.88 137.57 8.72 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.104 -1.438 . . . . 0.0 110.005 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.603 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.3 m80 -57.11 116.01 12.23 Favored Pre-proline 0 C--N 1.3 -1.574 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 177.054 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.438 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 50.9 Cg_exo -43.9 -9.38 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.391 0 CA-C-N 120.129 1.082 . . . . 0.0 112.755 -178.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.915 ' O ' HG13 ' B' ' 574' ' ' VAL . 6.9 mt-10 -105.26 -52.85 2.76 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.197 -0.939 . . . . 0.0 110.037 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.449 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 13.3 m170 -55.79 -4.97 0.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.822 -1.174 . . . . 0.0 109.75 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.469 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.2 t80 -122.26 52.15 1.32 Allowed 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.915 HG13 ' O ' ' B' ' 571' ' ' GLU . 18.7 m -92.53 177.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.396 0 CA-C-O 121.58 0.705 . . . . 0.0 109.218 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.667 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.74 145.83 32.68 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.476 -0.765 . . . . 0.0 109.088 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 576' ' ' ALA . . . . . 0.464 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -93.55 77.16 4.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 117.019 -1.873 . . . . 0.0 108.809 178.023 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 577' ' ' PHE . . . . . 0.424 ' HE2' ' HG ' ' A' ' 59' ' ' SER . 85.4 t80 -151.28 -45.96 0.11 Allowed 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 101.802 -3.407 . . . . 0.0 101.802 174.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.8 OUTLIER -126.83 154.98 43.61 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 111.677 -2.511 . . . . 0.0 105.314 177.559 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 1.108 ' H ' HD22 ' B' ' 579' ' ' LEU . 0.0 OUTLIER -104.74 14.32 29.89 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.659 -1.276 . . . . 0.0 111.281 -178.288 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.557 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -100.28 -39.25 8.12 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-N 120.909 1.686 . . . . 0.0 115.502 -176.181 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.4 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.3 tp-100 -162.57 142.44 9.48 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 122.29 2.314 . . . . 0.0 115.846 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.667 HD13 ' HB2' ' B' ' 575' ' ' CYS . 24.2 tp -136.91 169.75 17.24 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 174.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.446 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.0 m-20 -147.32 129.66 15.73 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.992 -1.067 . . . . 0.0 109.299 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.691 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.0 ptpp? -51.17 -17.72 0.73 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.539 -0.726 . . . . 0.0 109.753 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.29 -20.81 51.28 Favored Glycine 0 N--CA 1.487 2.072 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.3 p -133.88 28.11 3.89 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.582 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.6 OUTLIER -89.64 106.98 18.82 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.736 1.255 . . . . 0.0 109.836 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.72 167.71 10.61 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 179.486 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -152.08 157.27 41.39 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 122.634 1.207 . . . . 0.0 110.721 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.546 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 2.1 tp60 -154.87 146.12 22.88 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.519 HD21 ' HG3' ' B' ' 593' ' ' LYS . 0.3 OUTLIER 45.24 23.89 0.13 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.969 -1.082 . . . . 0.0 110.111 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.483 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.5 m-20 81.66 -4.9 1.57 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.598 -0.689 . . . . 0.0 110.809 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 593' ' ' LYS . . . . . 0.519 ' HG3' HD21 ' B' ' 591' ' ' ASN . 33.8 mttm -89.15 121.69 69.33 Favored Pre-proline 0 C--N 1.294 -1.827 0 O-C-N 121.296 -0.878 . . . . 0.0 109.457 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.48 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.7 Cg_exo -48.71 164.82 0.2 Allowed 'Trans proline' 0 N--CA 1.489 1.227 0 CA-C-N 119.945 1.016 . . . . 0.0 111.809 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.2 m-85 -170.51 141.48 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.626 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 20.6 m -76.16 155.74 34.32 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 104.455 -2.424 . . . . 0.0 104.455 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -60.77 -57.82 11.08 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 117.293 -1.763 . . . . 0.0 106.383 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.03 -29.09 1.34 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.503 -0.748 . . . . 0.0 109.359 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.8 m -80.89 -64.82 1.11 Allowed 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -53.35 -53.37 52.08 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.672 -0.642 . . . . 0.0 109.988 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.69 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -48.52 -42.34 32.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.092 -1.005 . . . . 0.0 108.776 -179.167 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 26.3 tptt -61.36 -20.4 62.95 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.38 -0.825 . . . . 0.0 110.26 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.623 HD13 HD12 ' A' ' 46' ' ' LEU . 7.7 mt -91.68 -56.29 3.16 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.69 -1.257 . . . . 0.0 110.409 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.546 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 3.8 m-85 -93.16 9.3 36.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.991 -1.068 . . . . 0.0 109.618 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.485 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 12.0 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.302 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 43.4 ttm . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.67 -45.08 0.24 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.755 -1.215 . . . . 0.0 108.323 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.905 ' H ' HD12 ' A' ' 3' ' ' LEU . 5.3 mp -63.7 -68.19 0.37 Allowed 'General case' 0 C--N 1.297 -1.699 0 CA-C-O 122.125 0.964 . . . . 0.0 109.226 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.422 ' O ' ' OD2' ' A' ' 4' ' ' ASP . 50.9 t0 -75.96 17.13 0.35 Allowed 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.486 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -61.5 -13.65 38.61 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 107.755 -2.138 . . . . 0.0 107.755 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.717 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -111.28 -95.25 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.24 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.546 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -152.03 -98.5 0.05 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.108 -0.995 . . . . 0.0 109.697 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.546 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -145.92 -62.99 0.02 OUTLIER Pre-proline 0 N--CA 1.5 2.042 0 O-C-N 120.985 -1.072 . . . . 0.0 110.816 -179.215 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -44.66 -35.8 9.61 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 CA-C-N 121.224 1.473 . . . . 0.0 110.071 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -111.57 -26.05 9.24 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.487 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.77 7.76 81.16 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.535 ' N ' ' O ' ' A' ' 8' ' ' MET . 18.5 t -165.85 -28.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.249 -1.147 . . . . 0.0 110.327 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.676 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 84.5 m-85 52.88 -105.01 0.22 Allowed 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.676 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 159.12 -40.4 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -164.98 10.32 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.765 -0.774 . . . . 0.0 109.942 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.529 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 75.9 45.56 16.21 Favored Glycine 0 N--CA 1.488 2.147 0 N-CA-C 107.558 -2.217 . . . . 0.0 107.558 -178.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 p -75.66 121.92 23.2 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.006 0.908 . . . . 0.0 110.726 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -141.35 124.07 16.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 178.676 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.628 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.87 130.97 40.98 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.59 -1.319 . . . . 0.0 109.872 -179.173 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.478 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.55 130.68 34.71 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 179.107 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.78 146.15 33.95 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.331 -0.855 . . . . 0.0 109.818 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.515 HG21 ' CE2' ' A' ' 92' ' ' PHE . 25.1 t -132.4 156.82 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-O 122.388 1.09 . . . . 0.0 110.042 178.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.538 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 15.7 m80 -128.42 98.91 5.21 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 104.195 -2.521 . . . . 0.0 104.195 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.56 ' O ' ' N ' ' A' ' 28' ' ' ASN . 9.0 t -73.15 94.35 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 C-N-CA 119.026 -1.07 . . . . 0.0 109.149 -178.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.491 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -64.99 169.08 5.64 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.742 -1.206 . . . . 0.0 107.742 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 0.9 OUTLIER 73.01 -45.52 0.62 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 25' ' ' THR . 9.1 tp -92.15 -32.62 15.05 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.56 ' N ' ' O ' ' A' ' 24' ' ' VAL . 31.3 t-20 73.05 9.91 5.32 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.447 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.433 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 60.0 mtp180 -87.03 -179.79 6.54 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 120.53 -1.356 . . . . 0.0 108.947 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.538 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 1.0 OUTLIER -143.04 123.05 13.57 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.875 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.6 t -127.69 158.64 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 CA-C-O 121.415 0.626 . . . . 0.0 110.771 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -123.34 139.95 53.52 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 32' ' ' THR . 2.2 mm? -119.73 113.33 20.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.536 -0.727 . . . . 0.0 109.89 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -60.41 104.35 0.32 Allowed 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.5 m -129.17 -169.03 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 122.01 0.909 . . . . 0.0 110.566 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.1 p -143.39 166.32 25.09 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.486 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -76.84 48.08 2.61 Favored Glycine 0 N--CA 1.485 1.937 0 C-N-CA 119.133 -1.508 . . . . 0.0 109.572 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.435 ' C ' HG21 ' A' ' 78' ' ' THR . 1.1 pp20? -153.59 2.43 0.27 Allowed 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.641 -0.917 . . . . 0.0 109.172 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 m -81.33 139.62 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 120.892 -1.13 . . . . 0.0 109.187 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.45 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m80 -79.09 140.74 37.78 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.462 HD13 ' HB3' ' A' ' 72' ' ' LEU . 74.3 mt -46.9 -57.31 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.156 -0.965 . . . . 0.0 109.476 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.77 -10.26 8.15 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.399 -1.481 . . . . 0.0 109.399 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -80.69 -24.26 58.68 Favored Glycine 0 N--CA 1.481 1.671 0 N-CA-C 106.51 -2.636 . . . . 0.0 106.51 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 45' ' ' MET . 0.4 OUTLIER -73.48 -55.65 11.89 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 114.681 -0.759 . . . . 0.0 109.094 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.534 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 39.7 mtm -46.22 -32.04 2.81 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.26 -0.9 . . . . 0.0 108.942 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.436 HD12 HD13 ' B' ' 603' ' ' LEU . 3.2 tt -71.65 -28.9 64.07 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.12 -179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -88.82 -59.26 2.28 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.125 -1.609 . . . . 0.0 111.748 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.61 HD13 ' CZ ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -45.69 -55.78 6.03 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.762 -1.211 . . . . 0.0 109.001 -178.588 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 72.7 t -51.81 -50.82 31.06 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 C-N-CA 119.931 -0.708 . . . . 0.0 109.875 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -47.68 -41.13 21.81 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.914 -1.116 . . . . 0.0 109.566 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -68.11 -38.45 82.28 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.289 -0.882 . . . . 0.0 109.861 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.422 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -66.51 -69.44 0.3 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.17 -0.956 . . . . 0.0 108.829 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.422 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 7.7 t70 75.07 83.29 0.1 Allowed 'General case' 0 N--CA 1.488 1.438 0 CA-C-O 121.977 0.894 . . . . 0.0 109.977 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.519 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.0 p -168.77 150.89 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.977 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.63 27.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.524 -0.735 . . . . 0.0 109.448 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.519 ' H ' ' C ' ' A' ' 54' ' ' VAL . 9.0 ttpp -78.75 147.36 33.41 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.902 -1.124 . . . . 0.0 109.634 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -69.48 112.53 6.07 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.543 -0.723 . . . . 0.0 109.249 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.536 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 79.3 m95 -108.39 -42.78 4.49 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.462 -0.774 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.8 t -45.45 -55.09 6.51 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 109.643 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -51.03 -33.98 27.67 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.537 ' CG ' ' O ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -71.41 115.46 10.61 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 121.943 0.878 . . . . 0.0 109.261 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -121.15 164.28 17.13 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.878 HD22 ' H ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -93.87 141.16 28.83 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.882 -1.136 . . . . 0.0 110.97 -177.893 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.511 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.34 140.99 51.57 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -101.85 91.84 4.55 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 17.0 pt-20 -55.56 -21.99 19.69 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.122 -0.986 . . . . 0.0 111.005 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.488 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -65.62 -19.38 65.89 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 105.647 -1.982 . . . . 0.0 105.647 178.154 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -123.22 -12.66 7.84 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.441 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 53.9 45.36 27.91 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -177.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -112.64 -173.93 2.35 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.492 0.663 . . . . 0.0 110.032 -178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.33 5.59 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.602 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.462 ' HB3' HD13 ' A' ' 41' ' ' ILE . 15.8 mt -62.05 84.1 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.122 0 O-C-N 120.231 -1.543 . . . . 0.0 110.278 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -113.6 14.02 18.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.565 ' NZ ' ' CZ ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -85.48 66.44 9.68 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.807 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.61 HG21 ' O ' ' B' ' 602' ' ' LYS . 1.9 m -64.99 -6.7 9.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.0 109.776 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -84.43 -35.82 22.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.164 -0.96 . . . . 0.0 110.07 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.0 m95 -91.65 -160.25 0.71 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.115 -0.991 . . . . 0.0 109.505 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.658 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -150.01 169.18 21.81 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 122.086 0.946 . . . . 0.0 109.238 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.527 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 9.1 mp -43.65 -63.81 0.77 Allowed 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.994 0.902 . . . . 0.0 109.257 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -43.01 -51.37 5.71 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.875 0.845 . . . . 0.0 110.075 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.658 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -45.44 -53.92 8.09 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-O 121.617 0.723 . . . . 0.0 109.794 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.565 ' CZ ' ' NZ ' ' A' ' 74' ' ' LYS . 10.5 m-85 -77.33 -40.21 44.98 Favored 'General case' 0 C--N 1.298 -1.653 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.524 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.21 10.47 10.75 Favored Glycine 0 N--CA 1.5 2.952 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.447 HG22 ' N ' ' A' ' 85' ' ' GLN . 55.4 mt -61.09 160.19 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 O-C-N 121.537 -0.978 . . . . 0.0 108.937 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.447 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.5 tp60 -171.83 -167.13 0.47 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.364 -0.835 . . . . 0.0 109.359 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.63 -23.79 66.22 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 110.169 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -78.51 -8.03 58.12 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.237 -0.914 . . . . 0.0 108.673 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.69 26.23 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.5 mmtp -93.17 119.92 32.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.992 -1.067 . . . . 0.0 109.067 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.7 mt -99.32 176.03 5.67 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 121.795 0.807 . . . . 0.0 110.5 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.511 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.1 mt-30 -133.63 147.44 51.47 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.677 ' CD2' HD12 ' A' ' 63' ' ' LEU . 4.2 m-85 -113.27 97.64 6.61 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.16 152.49 15.84 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.298 -0.876 . . . . 0.0 111.28 -177.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo . . . . . 0 N--CA 1.493 1.47 0 C-N-CA 122.899 2.399 . . . . 0.0 112.447 178.444 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.363 0.602 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 542' ' ' HIS . . . . . 0.522 ' O ' ' N ' ' B' ' 544' ' ' ARG . 2.2 m80 -77.69 -54.89 5.83 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.306 -0.871 . . . . 0.0 109.407 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -43.27 -17.96 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.591 -0.693 . . . . 0.0 110.416 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' B' ' 542' ' ' HIS . 17.3 mmt180 -78.38 87.02 4.42 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.065 -1.022 . . . . 0.0 109.415 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.475 ' HD2' ' H ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -130.33 -41.87 1.22 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.377 -0.827 . . . . 0.0 109.759 -179.312 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 546' ' ' GLY . . . . . 0.45 ' O ' ' O ' ' B' ' 545' ' ' ARG . . . -50.93 -106.66 0.01 OUTLIER Glycine 0 N--CA 1.494 2.551 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m -165.36 118.13 1.17 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.192 -1.181 . . . . 0.0 108.11 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.69 135.66 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.883 -1.135 . . . . 0.0 110.271 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.506 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.62 103.93 13.34 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 105.811 -1.922 . . . . 0.0 105.811 178.2 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.7 t -50.62 126.79 16.41 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.124 0.964 . . . . 0.0 109.727 -177.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.92 5.17 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 106.208 -2.757 . . . . 0.0 106.208 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.34 -35.85 7.39 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.68 56.4 6.2 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 122.656 1.217 . . . . 0.0 110.138 -178.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -140.49 123.45 10.03 Favored Pre-proline 0 C--N 1.293 -1.865 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -44.29 134.99 8.9 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 120.534 1.227 . . . . 0.0 114.485 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.5 mt -93.92 98.2 7.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 24.7 p -100.07 91.13 4.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.228 -0.92 . . . . 0.0 111.333 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.17 -97.07 0.16 Allowed Glycine 0 N--CA 1.486 2.028 0 N-CA-C 107.063 -2.415 . . . . 0.0 107.063 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.464 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 0.9 OUTLIER -111.94 150.64 30.23 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 177.878 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.32 125.78 14.89 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.227 1.013 . . . . 0.0 111.411 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 561' ' ' ILE . . . . . 0.608 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 47.0 mt -91.09 147.41 5.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.691 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 8.7 m -118.14 146.93 43.8 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 121.786 0.803 . . . . 0.0 109.072 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.725 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.22 -129.14 0.26 Allowed 'General case' 0 C--N 1.295 -1.768 0 CA-C-O 121.593 0.711 . . . . 0.0 109.359 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.6 mtt -65.65 26.28 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.725 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.21 -9.16 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -178.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -82.28 162.17 22.38 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -103.9 174.31 5.93 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -159.75 138.55 10.75 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 118.211 -1.395 . . . . 0.0 109.861 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.605 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.6 m80 -57.89 116.99 16.22 Favored Pre-proline 0 C--N 1.299 -1.63 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.425 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 53.1 Cg_exo -45.38 -9.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.403 0 CA-C-N 120.33 1.154 . . . . 0.0 111.793 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.921 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.9 mt-10 -100.02 -52.33 3.45 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.155 0.979 . . . . 0.0 109.977 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -58.21 -3.35 0.25 Allowed 'General case' 0 C--N 1.293 -1.884 0 O-C-N 120.696 -1.252 . . . . 0.0 109.9 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 31.2 t80 -127.68 57.53 1.52 Allowed 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.921 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.48 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.717 0.77 . . . . 0.0 111.403 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.619 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.86 146.12 35.86 Favored 'General case' 0 N--CA 1.504 2.266 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.803 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.36 74.69 3.33 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 116.623 -2.031 . . . . 0.0 109.974 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -63.66 0.14 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 101.962 -3.347 . . . . 0.0 101.962 172.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.2 p -114.22 80.42 1.39 Allowed 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 112.356 -2.202 . . . . 0.0 105.108 176.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.2 16.99 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 -176.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.05 -36.23 17.08 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 119.687 -1.883 . . . . 0.0 112.691 -178.606 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -159.47 139.59 11.9 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 119.295 -2.128 . . . . 0.0 115.138 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.619 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.2 tp -141.33 168.83 18.85 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.43 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 63.9 m-20 -148.25 140.24 23.99 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -0.965 . . . . 0.0 109.092 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.691 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.6 ptpp? -57.6 -19.65 27.35 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.394 -0.816 . . . . 0.0 109.636 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.3 -17.22 57.72 Favored Glycine 0 N--CA 1.485 1.96 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.11 25.35 4.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.943 -0.739 . . . . 0.0 109.422 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.519 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.12 114.45 26.39 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-O 122.283 1.04 . . . . 0.0 109.408 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -106.16 167.1 10.04 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 179.074 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.7 tt0 -153.48 157.54 40.0 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.618 -1.301 . . . . 0.0 111.323 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.5 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 1.2 tp-100 -156.81 146.21 20.5 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 178.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.479 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 47.07 23.55 0.3 Allowed 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.939 -1.101 . . . . 0.0 109.609 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.9 m-20 81.51 -6.0 1.54 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.759 -0.588 . . . . 0.0 110.973 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -88.17 118.1 69.17 Favored Pre-proline 0 C--N 1.295 -1.789 0 O-C-N 121.16 -0.963 . . . . 0.0 110.005 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.542 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.1 Cg_exo -49.87 164.45 0.4 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 CA-C-N 119.988 1.031 . . . . 0.0 111.855 179.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.542 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.73 137.98 1.36 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.276 -0.89 . . . . 0.0 109.877 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.06 156.6 35.66 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -61.61 -56.4 20.24 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.46 -28.63 0.94 Allowed 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 21.1 m -84.14 -65.88 0.96 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.449 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.7 OUTLIER -45.6 -52.29 10.83 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.594 0.712 . . . . 0.0 109.583 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.64 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -59.9 -40.95 90.51 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.574 -0.704 . . . . 0.0 109.393 -178.489 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.61 ' O ' HG21 ' A' ' 75' ' ' THR . 17.4 tptm -57.46 -26.27 60.97 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.157 -0.965 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.518 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -93.73 -56.66 2.82 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.028 -1.045 . . . . 0.0 111.123 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.5 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 0.3 OUTLIER -100.5 -29.62 12.26 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.178 -0.951 . . . . 0.0 110.727 -178.112 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.439 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 2.4 t . . . . . 0 N--CA 1.501 2.102 0 O-C-N 121.048 -1.033 . . . . 0.0 109.682 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ttt . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.94 -52.46 0.1 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 70.8 mt -48.33 -81.33 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 122.211 1.005 . . . . 0.0 109.192 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.408 ' O ' ' CG ' ' A' ' 4' ' ' ASP . 26.2 t70 50.32 18.75 0.45 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-O 121.745 0.783 . . . . 0.0 109.299 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.79 -16.86 48.11 Favored Glycine 0 N--CA 1.485 1.901 0 N-CA-C 107.323 -2.311 . . . . 0.0 107.323 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.733 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -107.07 -94.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -179.527 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.595 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -155.01 -102.45 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.163 -0.96 . . . . 0.0 110.061 -179.827 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.595 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -149.48 -62.47 0.02 OUTLIER Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 120.976 -1.077 . . . . 0.0 111.531 -178.417 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -42.89 -36.59 5.38 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 CA-C-N 121.034 1.405 . . . . 0.0 110.66 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.406 ' HB3' ' HE ' ' A' ' 7' ' ' ARG . 21.7 t70 -115.36 -25.23 8.06 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -90.71 11.24 72.34 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.3 -1.52 . . . . 0.0 109.3 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 8' ' ' MET . 49.2 t -164.96 -81.04 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.613 -0.933 . . . . 0.0 110.082 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.671 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 1.6 t80 78.29 -42.25 0.34 Allowed 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -178.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 163.73 -53.51 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -163.98 4.45 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.63 0 C-N-CA 119.475 -0.89 . . . . 0.0 110.461 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.51 25.66 6.86 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -90.19 122.53 33.21 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.454 -1.027 . . . . 0.0 109.544 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.65 121.44 32.15 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.606 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.7 128.73 35.82 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.073 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.484 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -83.45 135.03 34.83 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.246 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.07 145.85 35.58 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.399 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.7 t -137.81 111.07 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 CA-C-O 121.923 0.868 . . . . 0.0 109.756 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.514 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 6.9 m-70 -85.8 103.59 14.71 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.1 t -73.03 82.8 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 O-C-N 121.159 -0.963 . . . . 0.0 109.192 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.62 166.4 0.93 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.77 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.5 t0 73.48 -46.3 0.63 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.575 HD12 ' HD2' ' A' ' 29' ' ' ARG . 0.3 OUTLIER -85.76 -36.34 20.2 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.345 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 24' ' ' VAL . 33.0 t-20 75.72 13.28 2.91 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.339 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.575 ' HD2' HD12 ' A' ' 27' ' ' LEU . 43.5 mtp180 -90.41 -177.81 5.18 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.12 -0.988 . . . . 0.0 109.144 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.514 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 18.1 m-20 -144.45 116.87 8.54 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 32' ' ' THR . 19.9 t -119.41 157.4 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.693 0.759 . . . . 0.0 110.062 -178.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.424 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.12 133.01 42.34 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD22 ' C ' ' A' ' 32' ' ' THR . 2.7 mm? -113.84 113.24 24.63 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.705 -0.622 . . . . 0.0 109.334 -179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -59.95 105.95 0.45 Allowed 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' HG11 ' A' ' 39' ' ' VAL . 18.1 m -134.25 -169.51 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-O 121.988 0.899 . . . . 0.0 110.4 -178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.3 p -142.5 174.64 10.45 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.09 44.65 2.65 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.452 ' C ' HG21 ' A' ' 78' ' ' THR . 0.0 OUTLIER -145.58 4.07 1.01 Allowed 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.602 -0.94 . . . . 0.0 108.956 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.597 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -88.9 137.72 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.073 -1.017 . . . . 0.0 110.193 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.482 ' O ' ' N ' ' A' ' 43' ' ' GLY . 3.8 m-70 -79.25 144.38 34.39 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.138 -0.976 . . . . 0.0 108.912 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 87.9 mt -45.74 -58.54 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.257 -0.902 . . . . 0.0 110.175 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.07 -13.58 4.93 Favored Glycine 0 C--N 1.296 -1.677 0 N-CA-C 108.734 -1.746 . . . . 0.0 108.734 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.95 -26.33 58.47 Favored Glycine 0 N--CA 1.48 1.621 0 N-CA-C 108.54 -1.824 . . . . 0.0 108.54 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -83.32 -53.95 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.469 -1.018 . . . . 0.0 110.642 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -27.68 44.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.222 -1.549 . . . . 0.0 108.862 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -64.13 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -52.28 -53.99 37.07 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.431 -0.793 . . . . 0.0 110.17 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.5 tp -44.93 -51.52 9.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.508 -0.745 . . . . 0.0 110.098 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.81 -47.13 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.815 -1.178 . . . . 0.0 109.008 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -48.03 -40.62 23.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.275 -0.891 . . . . 0.0 109.474 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -69.21 -43.87 73.23 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.406 -0.809 . . . . 0.0 110.011 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -48.96 -58.1 5.43 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.566 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.4 t70 74.0 75.47 0.12 Allowed 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.938 0.875 . . . . 0.0 110.135 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.493 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -175.16 132.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.292 -1.905 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.593 ' HB3' HD21 ' B' ' 579' ' ' LEU . 7.1 mmtt -69.46 35.86 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.458 -0.776 . . . . 0.0 109.381 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.539 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 39.4 tttp -78.95 135.42 36.94 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.628 -1.295 . . . . 0.0 108.681 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.406 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 14.3 t70 -50.02 119.72 3.83 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.223 -0.923 . . . . 0.0 108.958 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 55.1 m95 -120.23 -35.93 3.34 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.58 -0.7 . . . . 0.0 110.539 -179.343 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 58' ' ' TRP . 8.2 t -43.15 -50.27 6.28 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.293 -0.879 . . . . 0.0 109.164 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -55.52 -43.06 75.38 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.603 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.4 OUTLIER -71.16 115.15 9.97 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.582 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -129.56 168.99 15.58 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.624 ' O ' HD12 ' A' ' 63' ' ' LEU . 0.3 OUTLIER -95.71 149.37 21.55 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 122.289 1.042 . . . . 0.0 110.679 -178.905 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.623 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -141.6 142.87 33.46 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 -178.71 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.696 ' HB2' HD21 ' A' ' 72' ' ' LEU . 5.1 t90 -94.96 90.8 6.1 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.292 -1.505 . . . . 0.0 108.955 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.416 ' C ' ' N ' ' A' ' 68' ' ' LYS . 14.3 pt-20 -55.44 -23.46 25.41 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.069 -1.019 . . . . 0.0 110.585 -179.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.483 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 12.6 mmtp -66.53 -10.4 44.57 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.416 ' N ' ' C ' ' A' ' 66' ' ' GLU . 17.7 mmtt -133.29 -11.08 2.87 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.616 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.3 mpp_? 52.73 47.18 25.24 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 4.0 t -115.43 -172.15 2.09 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.472 0.653 . . . . 0.0 109.834 -178.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.56 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.8 99.21 5.04 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 177.02 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.696 HD21 ' HB2' ' A' ' 65' ' ' TRP . 0.5 OUTLIER -62.38 87.72 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.182 0 O-C-N 120.667 -1.271 . . . . 0.0 108.832 -176.931 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 13.01 12.55 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.96 74.72 9.67 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -25.22 68.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.909 -1.12 . . . . 0.0 108.354 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.48 ' O ' ' CE3' ' A' ' 77' ' ' TRP . 2.8 t60 -82.83 73.71 9.84 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.48 ' CE3' ' O ' ' A' ' 76' ' ' HIS . 0.1 OUTLIER 161.04 -167.77 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 -179.144 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.68 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -149.44 -172.0 4.03 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.776 -1.202 . . . . 0.0 109.432 -179.756 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -62.49 -58.82 6.24 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -42.95 -50.98 5.77 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.695 0.76 . . . . 0.0 109.874 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.68 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -46.54 -54.39 9.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-O 121.58 0.705 . . . . 0.0 109.684 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -73.71 -41.11 63.04 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.117 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 114.11 8.8 16.83 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 108.131 -1.988 . . . . 0.0 108.131 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 58.9 mt -61.07 157.94 2.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.755 -0.85 . . . . 0.0 109.135 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -164.16 -165.78 1.04 Allowed 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.61 -24.85 63.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.468 -0.77 . . . . 0.0 110.022 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.4 p30 -78.6 -7.98 58.15 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 108.769 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.61 26.12 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.0 mmtp -93.82 116.02 28.46 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.982 -1.074 . . . . 0.0 110.018 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.484 ' HG ' HD12 ' A' ' 20' ' ' LEU . 12.2 mt -91.16 176.65 6.51 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 178.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.623 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.9 mt-30 -135.6 171.73 14.03 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.54 97.62 3.19 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.417 ' CB ' ' OG1' ' A' ' 25' ' ' THR . 3.0 t -160.99 151.65 15.16 Favored Pre-proline 0 N--CA 1.491 1.582 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.85 -177.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo . . . . . 0 N--CA 1.493 1.455 0 C-N-CA 122.766 2.311 . . . . 0.0 112.408 178.417 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 542' ' ' HIS . . . . . 0.4 ' C ' ' H ' ' B' ' 544' ' ' ARG . 0.9 OUTLIER -123.35 -52.6 1.83 Allowed 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.877 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.467 ' O ' ' O ' ' B' ' 544' ' ' ARG . 4.0 pt-20 -76.01 9.94 2.17 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.565 ' CG ' HH21 ' B' ' 544' ' ' ARG . 0.1 OUTLIER 37.39 -164.0 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.239 0 CA-C-O 121.179 0.514 . . . . 0.0 111.615 178.977 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 545' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.41 -164.55 0.93 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.377 -0.827 . . . . 0.0 110.024 -178.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -91.06 -94.83 1.27 Allowed Glycine 0 N--CA 1.496 2.655 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.531 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.0 m -157.19 116.68 3.39 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.86 136.39 57.96 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.407 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.489 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.61 103.9 13.3 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.245 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -51.1 126.96 17.83 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.198 0.999 . . . . 0.0 109.641 -177.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -34.56 5.42 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.172 -2.771 . . . . 0.0 106.172 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.73 -35.47 7.36 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 178.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.08 56.22 6.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 122.742 1.258 . . . . 0.0 110.025 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -141.02 125.02 10.31 Favored Pre-proline 0 C--N 1.293 -1.856 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -44.24 137.65 7.5 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 120.372 1.169 . . . . 0.0 114.993 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.531 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.8 mt -96.58 98.72 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.007 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 71.8 p -99.84 93.41 5.78 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.234 -0.916 . . . . 0.0 111.356 -177.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 153.25 -95.4 0.15 Allowed Glycine 0 N--CA 1.487 2.082 0 N-CA-C 107.406 -2.278 . . . . 0.0 107.406 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.477 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.29 152.48 31.3 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.1 p -144.48 126.19 15.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.012 -1.055 . . . . 0.0 111.265 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.8 mt -90.6 146.5 6.12 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.78 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.8 m -118.51 146.74 44.3 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 121.888 0.852 . . . . 0.0 109.049 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.85 -129.0 0.25 Allowed 'General case' 0 C--N 1.295 -1.79 0 CA-C-O 121.607 0.718 . . . . 0.0 109.407 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 14.1 mtp -65.57 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.02 -8.75 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -178.074 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -81.84 159.93 23.62 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt -102.91 174.47 5.86 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.69 136.18 8.01 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.231 -1.388 . . . . 0.0 109.957 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.588 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.79 115.81 10.52 Favored Pre-proline 0 C--N 1.3 -1.567 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 177.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.435 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 47.7 Cg_exo -46.22 -8.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.452 0 CA-C-N 120.353 1.162 . . . . 0.0 111.814 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.921 ' O ' HG13 ' B' ' 574' ' ' VAL . 12.2 mt-10 -100.64 -52.84 3.23 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.021 0.915 . . . . 0.0 110.06 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.474 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.2 m170 -57.03 -4.7 0.19 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.848 -1.157 . . . . 0.0 109.863 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.457 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.6 t80 -124.77 54.53 1.4 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 178.198 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.921 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -93.74 177.6 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.827 0.823 . . . . 0.0 110.738 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.588 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -76.9 149.33 36.07 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -96.35 76.07 2.95 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 116.787 -1.965 . . . . 0.0 110.736 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.84 -56.97 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 172.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.8 p -117.21 121.99 42.74 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 112.535 -2.121 . . . . 0.0 106.772 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 55' ' ' LYS . 10.8 mp -75.01 14.19 0.56 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 121.05 -1.031 . . . . 0.0 111.981 -177.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -92.27 -39.5 11.48 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 119.361 -2.087 . . . . 0.0 115.277 -175.802 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.403 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.2 tp-100 -162.72 141.57 8.79 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 122.513 2.415 . . . . 0.0 116.332 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.7 tp -142.04 168.69 19.15 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 174.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.504 ' O ' ' N ' ' B' ' 587' ' ' PHE . 72.2 m-20 -149.82 135.86 18.76 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.917 -1.114 . . . . 0.0 109.048 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.78 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 1.2 ptpp? -54.87 -14.37 1.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.21 -0.931 . . . . 0.0 109.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 585' ' ' GLY . . . . . 0.408 ' N ' ' C ' ' B' ' 583' ' ' ASN . . . -94.72 -15.5 45.93 Favored Glycine 0 N--CA 1.486 2.019 0 N-CA-C 108.735 -1.746 . . . . 0.0 108.735 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.1 p -136.72 26.17 3.07 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.907 -0.76 . . . . 0.0 108.983 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 2.2 p90 -89.25 108.18 19.47 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 122.446 1.117 . . . . 0.0 109.338 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.56 165.63 11.53 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.429 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -153.2 157.29 40.02 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 122.656 1.217 . . . . 0.0 110.718 -178.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.429 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 1.8 tp60 -156.56 145.96 20.62 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.48 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 46.79 23.58 0.27 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.037 -1.039 . . . . 0.0 109.497 -179.642 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.48 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 82.55 -7.19 1.29 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.818 -0.551 . . . . 0.0 110.865 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -87.83 116.45 66.2 Favored Pre-proline 0 C--N 1.295 -1.763 0 O-C-N 121.123 -0.986 . . . . 0.0 110.067 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.3 Cg_exo -50.26 164.34 0.49 Allowed 'Trans proline' 0 N--CA 1.488 1.176 0 CA-C-N 120.026 1.045 . . . . 0.0 111.698 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 24.2 m-85 -170.4 140.5 1.83 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.259 -0.901 . . . . 0.0 109.837 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.7 m -69.63 154.72 41.59 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 175.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -58.7 -56.97 15.34 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.31 -30.04 1.9 Allowed 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 6.6 m -81.24 -63.14 1.46 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.554 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.48 -54.34 28.07 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.437 0.637 . . . . 0.0 110.375 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.692 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -52.78 -41.8 64.44 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.375 -0.828 . . . . 0.0 109.902 -178.07 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.83 -23.22 66.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.031 -1.043 . . . . 0.0 110.719 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.453 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.3 OUTLIER -91.86 -56.3 3.14 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.571 -1.331 . . . . 0.0 111.915 -177.09 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.449 ' C ' ' SG ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -103.7 4.77 35.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.185 -0.947 . . . . 0.0 111.155 -177.425 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.449 ' SG ' ' C ' ' B' ' 604' ' ' PHE . 2.1 m . . . . . 0 N--CA 1.498 1.95 0 O-C-N 120.714 -1.241 . . . . 0.0 109.445 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttm . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.84 -43.99 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.103 -0.998 . . . . 0.0 108.774 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.899 ' H ' HD12 ' A' ' 3' ' ' LEU . 5.6 mp -58.85 -66.47 0.49 Allowed 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 122.175 0.988 . . . . 0.0 109.111 179.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -74.49 18.66 0.15 Allowed 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.501 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -59.72 -15.87 35.67 Favored Glycine 0 N--CA 1.488 2.103 0 N-CA-C 108.016 -2.034 . . . . 0.0 108.016 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.692 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -106.85 -98.64 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -179.13 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.545 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -152.69 -99.34 0.05 Allowed 'General case' 0 N--CA 1.486 1.342 0 O-C-N 120.816 -1.177 . . . . 0.0 109.872 -179.626 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.545 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -145.5 -62.13 0.02 OUTLIER Pre-proline 0 N--CA 1.5 2.069 0 O-C-N 120.948 -1.095 . . . . 0.0 110.763 -179.111 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -43.28 -33.81 4.13 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 CA-C-N 121.017 1.399 . . . . 0.0 110.24 178.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -116.57 -27.05 6.84 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.534 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.45 5.4 68.54 Favored Glycine 0 N--CA 1.486 2.013 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 9.7 t -172.26 -55.19 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.356 -1.085 . . . . 0.0 110.154 -179.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.643 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 1.5 t80 78.21 -45.44 0.41 Allowed 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 -178.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.643 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 151.99 -27.62 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -174.79 -21.71 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 112.86 14.46 10.15 Favored Glycine 0 N--CA 1.499 2.838 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.541 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.1 OUTLIER -98.61 126.84 44.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.383 -1.069 . . . . 0.0 109.839 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.5 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.5 OUTLIER -128.58 123.86 34.46 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.296 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.83 137.75 39.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.903 . . . . 0.0 109.561 -179.465 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.23 129.17 34.86 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.06 143.29 37.55 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.882 -1.136 . . . . 0.0 108.353 179.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.47 153.24 30.61 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-O 121.65 0.738 . . . . 0.0 109.415 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.464 ' H ' ' HA ' ' A' ' 91' ' ' GLN . 24.5 m80 -123.26 102.16 7.78 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.005 -1.479 . . . . 0.0 107.005 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.96 102.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.503 ' C ' ' H ' ' A' ' 27' ' ' LEU . 53.9 p -75.72 -35.39 60.26 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.34 -0.85 . . . . 0.0 109.675 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -76.01 19.05 0.24 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.181 -0.95 . . . . 0.0 108.496 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.503 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -154.74 -28.51 0.11 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.627 -0.671 . . . . 0.0 109.203 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 24.2 t-20 82.97 12.64 0.46 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 122.135 -0.353 . . . . 0.0 110.199 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -95.27 -178.32 4.41 Favored 'General case' 0 C--N 1.309 -1.181 0 O-C-N 120.85 -1.157 . . . . 0.0 109.881 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.421 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 1.3 m-20 -138.44 121.04 16.22 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.257 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.7 t -119.46 154.58 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.788 0.804 . . . . 0.0 110.577 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -130.8 128.89 41.62 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.811 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 32' ' ' THR . 3.0 mm? -115.1 115.31 26.58 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.39 0.614 . . . . 0.0 110.034 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.541 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.7 tpt180 -59.62 112.29 1.74 Allowed 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -140.73 -171.21 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.983 0.897 . . . . 0.0 110.461 -179.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 p -144.43 176.22 9.54 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.85 44.57 3.14 Favored Glycine 0 N--CA 1.481 1.681 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.502 ' C ' HG21 ' A' ' 78' ' ' THR . 3.4 pt-20 -145.61 1.68 0.92 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.589 -0.948 . . . . 0.0 108.881 178.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.457 ' O ' HG22 ' A' ' 78' ' ' THR . 1.4 m -89.14 134.0 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.939 -1.101 . . . . 0.0 109.547 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.46 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.8 m-70 -73.45 147.37 44.22 Favored 'General case' 0 C--N 1.29 -2.001 0 O-C-N 120.948 -1.095 . . . . 0.0 108.175 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.434 ' C ' ' N ' ' A' ' 43' ' ' GLY . 81.6 mt -48.75 -51.39 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 120.998 -1.064 . . . . 0.0 108.947 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.52 -10.87 6.42 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 108.482 -1.847 . . . . 0.0 108.482 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -74.93 -26.82 65.88 Favored Glycine 0 N--CA 1.483 1.773 0 N-CA-C 107.919 -2.073 . . . . 0.0 107.919 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 45' ' ' MET . 2.1 t -84.13 -42.95 17.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.062 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.404 ' C ' ' O ' ' A' ' 44' ' ' VAL . 40.9 mtm -45.51 -36.25 4.4 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.26 -65.81 0.73 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 121.398 0.618 . . . . 0.0 110.095 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 48.2 mttm -52.88 -55.67 21.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.446 -0.783 . . . . 0.0 111.275 -178.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -45.05 -56.69 4.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.946 -1.097 . . . . 0.0 109.759 -178.524 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.5 t -60.64 -47.36 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.04 -1.037 . . . . 0.0 110.117 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -45.06 -39.63 5.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.153 -0.967 . . . . 0.0 109.85 -179.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -65.52 -57.06 9.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.318 -0.864 . . . . 0.0 110.392 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -67.17 0.45 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t0 62.62 89.03 0.09 Allowed 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.863 0.839 . . . . 0.0 109.242 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.704 ' O ' HG22 ' A' ' 54' ' ' VAL . 1.6 p -155.67 33.13 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.303 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 tptt 41.23 17.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.778 -0.576 . . . . 0.0 110.649 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.576 ' N ' ' O ' ' A' ' 54' ' ' VAL . 16.7 ttmm -78.7 146.72 33.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.967 -1.083 . . . . 0.0 109.027 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.53 115.09 2.12 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.509 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 60.4 m95 -117.72 -33.66 4.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.609 -0.682 . . . . 0.0 109.905 -179.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.5 t -42.99 -55.78 3.62 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.433 -0.792 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -50.99 -43.65 60.76 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.211 -0.93 . . . . 0.0 108.521 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -72.45 134.17 45.21 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.732 0.777 . . . . 0.0 110.214 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.86 -179.31 6.51 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.833 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -95.12 137.73 33.77 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.812 -1.18 . . . . 0.0 110.682 -179.384 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.498 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -125.88 148.97 49.03 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.555 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -105.13 92.08 4.07 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.711 -1.243 . . . . 0.0 108.708 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -54.31 -23.57 15.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.255 -0.903 . . . . 0.0 110.734 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.514 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 23.7 mmtp -67.82 -10.56 53.95 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -134.0 -11.43 2.6 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.132 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.555 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.63 45.84 27.86 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -111.93 -171.05 1.77 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.322 0.582 . . . . 0.0 109.804 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.551 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.56 99.68 5.46 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 177.608 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.41 ' HB3' HD13 ' A' ' 41' ' ' ILE . 36.1 mt -60.07 88.47 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.69 1.233 . . . . 0.0 110.634 -176.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.476 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.0 pp -123.04 13.04 9.71 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 178.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' A' ' 76' ' ' HIS . 10.1 mmpt? -75.37 43.18 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.735 -0.603 . . . . 0.0 109.966 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.686 HG21 ' O ' ' B' ' 602' ' ' LYS . 3.7 m -54.75 -6.37 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.982 -1.074 . . . . 0.0 109.58 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.48 ' H ' ' C ' ' A' ' 74' ' ' LYS . 87.2 m-70 -55.97 -68.57 0.19 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.252 -0.905 . . . . 0.0 110.861 -179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -99.05 -115.86 0.15 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.137 -0.977 . . . . 0.0 110.636 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.502 HG21 ' C ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -153.41 155.44 36.37 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.2 pt? -43.8 -51.1 7.58 Favored 'General case' 0 C--N 1.295 -1.78 0 O-C-N 121.275 -0.89 . . . . 0.0 110.654 179.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.438 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 17.6 t70 -45.49 -32.25 2.13 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.213 -0.929 . . . . 0.0 109.852 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.554 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -72.55 -32.01 65.72 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 -179.623 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.554 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.5 OUTLIER -73.33 -49.55 26.79 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 124.28 4.55 7.64 Favored Glycine 0 N--CA 1.51 3.619 0 N-CA-C 108.65 -1.78 . . . . 0.0 108.65 179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.9 mt -60.08 162.29 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -156.22 -164.64 1.73 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.048 -1.033 . . . . 0.0 108.741 178.697 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -73.57 -21.27 60.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.175 -0.953 . . . . 0.0 109.833 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.1 3.24 43.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.335 -0.853 . . . . 0.0 109.402 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.98 113.61 25.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.355 -0.841 . . . . 0.0 109.315 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -97.39 125.77 42.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.059 -1.026 . . . . 0.0 109.228 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.6 mt -112.7 178.61 4.23 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.714 0.769 . . . . 0.0 109.388 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.498 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.2 mt-30 -129.9 168.19 17.01 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -123.73 90.88 3.35 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.53 169.26 9.81 Favored Pre-proline 0 N--CA 1.5 2.061 0 O-C-N 121.737 -0.602 . . . . 0.0 110.332 -176.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo . . . . . 0 N--CA 1.493 1.494 0 C-N-CA 123.193 2.595 . . . . 0.0 112.643 179.0 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 542' ' ' HIS . . . . . 0.4 ' ND1' ' N ' ' B' ' 542' ' ' HIS . 1.4 m-70 -53.11 -79.97 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.141 -0.974 . . . . 0.0 109.276 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.439 ' CG ' ' H ' ' B' ' 544' ' ' ARG . 0.7 OUTLIER -134.05 -98.89 0.26 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.149 -0.969 . . . . 0.0 108.957 179.711 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.439 ' H ' ' CG ' ' B' ' 543' ' ' GLU . 10.4 mpt_? -82.8 -93.82 0.06 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.249 -0.907 . . . . 0.0 111.062 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.576 ' NE ' ' H ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -87.6 -106.02 0.07 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.126 -0.984 . . . . 0.0 110.614 -178.123 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 546' ' ' GLY . . . . . 0.576 ' H ' ' NE ' ' B' ' 545' ' ' ARG . . . 162.29 -94.83 0.13 Allowed Glycine 0 N--CA 1.492 2.429 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 -179.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.543 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.1 m -152.35 113.78 4.29 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 179.335 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.18 137.13 58.24 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.23 -0.919 . . . . 0.0 110.653 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.55 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.86 103.84 13.46 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 178.197 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.5 t -49.62 125.99 12.66 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.086 0.946 . . . . 0.0 109.624 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.33 -34.95 5.2 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 106.444 -2.663 . . . . 0.0 106.444 -177.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.17 -35.29 7.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.01 56.27 6.77 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 122.694 1.235 . . . . 0.0 109.899 -178.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt -140.83 124.7 10.34 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -43.7 138.29 5.8 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 CA-C-N 120.428 1.189 . . . . 0.0 114.83 -178.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.55 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.6 mt -97.61 98.69 7.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 51.8 p -100.06 91.35 4.74 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 121.955 0.883 . . . . 0.0 111.234 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.41 -96.66 0.16 Allowed Glycine 0 N--CA 1.488 2.102 0 N-CA-C 107.349 -2.3 . . . . 0.0 107.349 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.484 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 6.0 mmt-85 -113.08 153.02 28.84 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.027 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.5 p -144.83 126.47 15.13 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.022 -1.049 . . . . 0.0 111.425 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.4 mt -90.61 146.15 6.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 10.9 m -121.5 146.61 46.75 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.0 0.905 . . . . 0.0 109.151 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.738 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -128.92 0.26 Allowed 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.9 mtp -65.75 25.88 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.738 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.0 -8.56 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.84 149.07 28.5 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.5 mmmt -96.02 174.72 6.78 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.43 134.67 7.3 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.436 -1.306 . . . . 0.0 109.939 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.581 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.2 m80 -55.42 114.8 7.87 Favored Pre-proline 0 C--N 1.303 -1.428 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 177.062 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.434 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 47.1 Cg_exo -45.67 -10.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 CA-C-N 120.306 1.145 . . . . 0.0 111.964 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.745 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.9 mt-10 -100.64 -53.01 3.19 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 122.052 0.93 . . . . 0.0 110.067 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.499 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.7 m170 -55.41 -5.92 0.15 Allowed 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.589 -1.319 . . . . 0.0 109.839 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.471 ' H ' ' C ' ' B' ' 571' ' ' GLU . 21.2 t80 -124.27 52.53 1.49 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.745 HG13 ' O ' ' B' ' 571' ' ' GLU . 11.4 m -93.47 176.89 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 CA-C-O 121.514 0.673 . . . . 0.0 110.125 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.549 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.44 144.03 38.12 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 107.597 -1.261 . . . . 0.0 107.597 179.029 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -90.89 74.09 6.49 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 116.258 -2.177 . . . . 0.0 109.488 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -153.99 -65.85 0.14 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 172.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.536 ' O ' ' N ' ' B' ' 580' ' ' LYS . 17.0 p -110.67 84.03 1.86 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 112.514 -2.13 . . . . 0.0 105.616 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 0.857 HD22 ' N ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.49 15.1 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.67 -38.7 15.64 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 119.542 -1.973 . . . . 0.0 112.542 -178.267 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.461 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.4 tp-100 -162.25 142.16 9.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 119.5 -2.0 . . . . 0.0 115.02 178.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.549 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.7 tp -136.7 170.1 16.63 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 175.335 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.502 ' O ' ' N ' ' B' ' 587' ' ' PHE . 77.2 m-20 -145.2 129.26 17.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.066 -1.022 . . . . 0.0 109.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -50.84 -22.64 2.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.522 -0.736 . . . . 0.0 109.651 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.12 -18.1 59.89 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.004 -1.638 . . . . 0.0 109.004 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.9 p -133.12 26.31 4.22 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.568 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.3 OUTLIER -89.48 108.53 19.7 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.579 1.18 . . . . 0.0 109.974 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.44 168.4 10.01 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.411 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.46 157.15 40.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.747 -1.221 . . . . 0.0 110.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.456 ' OE1' ' CD2' ' B' ' 600' ' ' PHE . 1.6 tp60 -150.84 144.2 24.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.492 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.5 OUTLIER 41.98 27.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.217 -0.927 . . . . 0.0 110.452 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 3.6 m-20 84.26 -8.37 0.98 Allowed 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.758 -0.588 . . . . 0.0 111.05 179.094 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 53.2 mttt -88.18 116.78 67.26 Favored Pre-proline 0 C--N 1.296 -1.732 0 O-C-N 121.162 -0.961 . . . . 0.0 109.973 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.2 Cg_exo -50.2 163.93 0.54 Allowed 'Trans proline' 0 N--CA 1.492 1.434 0 CA-C-N 119.887 0.995 . . . . 0.0 112.576 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.526 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 21.6 m-85 -170.84 139.65 1.51 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.404 -0.81 . . . . 0.0 109.589 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 10.0 m -68.5 157.23 36.4 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 175.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -60.2 -55.58 32.05 Favored 'General case' 0 C--N 1.294 -1.836 0 C-N-CA 117.253 -1.779 . . . . 0.0 106.56 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.5 -31.28 2.64 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.331 -0.856 . . . . 0.0 109.182 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.28 -56.52 4.15 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.456 ' CD2' ' OE1' ' B' ' 590' ' ' GLN . 2.4 t80 -60.32 -53.53 56.56 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.443 0.64 . . . . 0.0 110.498 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.654 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.45 -43.34 62.06 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.117 -0.989 . . . . 0.0 109.431 -178.348 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.686 ' O ' HG21 ' A' ' 75' ' ' THR . 0.5 OUTLIER -58.82 -20.43 50.36 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.994 -1.066 . . . . 0.0 110.163 -179.208 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.409 ' N ' HD23 ' B' ' 603' ' ' LEU . 1.2 mt -91.98 -56.93 2.89 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.651 -1.28 . . . . 0.0 110.331 -178.65 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' C ' ' B' ' 605' ' ' CYS . 24.5 m-85 -106.41 32.36 4.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.508 -0.745 . . . . 0.0 109.935 -179.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' B' ' 604' ' ' PHE . 3.9 t . . . . . 0 N--CA 1.502 2.145 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.759 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 mtm . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 122.455 1.122 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -158.87 -45.56 0.06 Allowed 'General case' 0 C--N 1.293 -1.878 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.025 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.592 ' O ' ' CG ' ' A' ' 4' ' ' ASP . 25.9 mt -51.81 -69.57 0.11 Allowed 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.545 -0.722 . . . . 0.0 109.951 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.592 ' CG ' ' O ' ' A' ' 3' ' ' LEU . 2.6 p30 63.08 -44.26 0.21 Allowed 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.656 -177.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.476 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 110.05 -15.56 30.8 Favored Glycine 0 N--CA 1.494 2.501 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.533 ' N ' ' OD2' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -114.22 -106.89 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.247 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.499 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -156.05 -96.81 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.336 -1.477 . . . . 0.0 110.227 -179.671 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.57 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -131.83 -53.62 0.03 OUTLIER Pre-proline 0 N--CA 1.508 2.458 0 O-C-N 120.924 -1.11 . . . . 0.0 111.554 -179.05 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -58.31 -36.3 97.81 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 CA-C-N 121.079 1.421 . . . . 0.0 110.216 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -107.24 -25.92 11.28 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.11 -7.11 83.89 Favored Glycine 0 N--CA 1.487 2.039 0 N-CA-C 108.861 -1.696 . . . . 0.0 108.861 179.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.594 ' SG ' ' N ' ' A' ' 13' ' ' TYR . 12.4 t -159.38 -103.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.595 -0.944 . . . . 0.0 109.166 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.594 ' N ' ' SG ' ' A' ' 12' ' ' CYS . 42.1 m-85 -164.92 -112.95 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.302 -0.874 . . . . 0.0 108.997 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -176.6 -38.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.185 -0.947 . . . . 0.0 109.39 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -144.89 1.33 0.99 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.357 -0.84 . . . . 0.0 109.708 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.22 36.42 45.48 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.534 ' OG1' ' N ' ' A' ' 18' ' ' TRP . 2.7 t -167.85 178.46 5.2 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 117.548 -1.661 . . . . 0.0 111.693 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.534 ' N ' ' OG1' ' A' ' 17' ' ' THR . 0.5 OUTLIER -165.48 127.87 2.09 Favored 'General case' 0 C--N 1.277 -2.552 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.673 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -83.78 132.21 34.85 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.961 -1.087 . . . . 0.0 109.521 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.488 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.86 133.51 34.73 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.174 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.15 145.73 35.49 Favored 'General case' 0 C--N 1.295 -1.797 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.176 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -137.35 114.11 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.7 0.762 . . . . 0.0 110.015 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -85.76 103.77 14.84 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.526 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.63 107.01 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 27' ' ' LEU . 41.5 p -78.2 -41.08 35.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.327 -0.858 . . . . 0.0 110.037 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -73.02 20.53 0.08 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.055 -1.028 . . . . 0.0 108.793 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.7 mt -154.49 -33.0 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' VAL . 24.7 t-20 85.23 14.09 0.19 Allowed 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 120.707 0.289 . . . . 0.0 110.429 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.0 mtp-105 -95.58 -178.27 4.35 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 120.911 -1.118 . . . . 0.0 110.036 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -135.86 116.98 14.39 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.1 t -115.36 155.13 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.681 0.753 . . . . 0.0 110.004 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.46 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -134.37 131.59 38.45 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' O ' ' A' ' 32' ' ' THR . 2.1 mm? -118.54 115.91 25.57 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.53 ' O ' HG13 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -61.6 133.85 56.13 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.53 HG13 ' O ' ' A' ' 34' ' ' ARG . 13.9 m -160.7 -170.22 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.019 0 CA-C-O 122.071 0.938 . . . . 0.0 110.012 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.417 ' C ' ' H ' ' A' ' 38' ' ' GLU . 0.8 OUTLIER -142.13 171.16 14.43 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.047 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -77.58 45.04 2.33 Favored Glycine 0 C--N 1.293 -1.831 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.435 ' C ' HG21 ' A' ' 78' ' ' THR . 0.7 OUTLIER -144.99 3.49 1.06 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.765 -0.844 . . . . 0.0 108.926 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.577 ' O ' HG22 ' A' ' 78' ' ' THR . 2.6 m -90.1 135.69 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.041 -1.037 . . . . 0.0 110.076 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.445 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.8 OUTLIER -72.5 142.46 48.54 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 120.944 -1.098 . . . . 0.0 108.217 178.932 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.466 ' C ' ' N ' ' A' ' 43' ' ' GLY . 94.1 mt -47.8 -55.54 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.051 -1.031 . . . . 0.0 109.268 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.512 ' H ' HG23 ' A' ' 75' ' ' THR . . . -55.8 -8.9 2.32 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.531 -1.828 . . . . 0.0 108.531 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -75.12 -28.25 62.62 Favored Glycine 0 N--CA 1.484 1.869 0 N-CA-C 107.585 -2.206 . . . . 0.0 107.585 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.29 -40.88 16.53 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.475 ' O ' HG23 ' A' ' 49' ' ' VAL . 42.1 mtm -47.64 -35.02 8.73 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.57 -65.72 0.79 Allowed 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.745 -0.597 . . . . 0.0 109.954 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 53.5 mttm -49.39 -59.85 3.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.372 -0.83 . . . . 0.0 110.8 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.51 -55.56 6.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.016 -1.052 . . . . 0.0 109.39 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 45' ' ' MET . 70.0 t -56.5 -48.76 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -46.72 -40.71 13.87 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.053 -1.03 . . . . 0.0 109.591 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -76.6 -36.83 57.26 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.411 -0.805 . . . . 0.0 110.853 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.484 HD12 ' CG1' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -59.74 -65.01 0.75 Allowed 'General case' 0 C--N 1.305 -1.342 0 O-C-N 120.914 -1.116 . . . . 0.0 108.904 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 67.16 79.25 0.23 Allowed 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 121.822 0.82 . . . . 0.0 109.816 179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.562 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.7 p -171.03 146.06 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 C-N-CA 119.696 -0.802 . . . . 0.0 110.005 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.28 34.91 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.315 -0.866 . . . . 0.0 108.931 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.562 ' H ' ' C ' ' A' ' 54' ' ' VAL . 16.0 ttmm -77.74 161.49 27.67 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.127 -0.983 . . . . 0.0 108.873 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -77.13 90.64 3.66 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 109.027 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.464 ' O ' ' O ' ' A' ' 61' ' ' HIS . 11.1 m0 -72.8 -58.15 3.56 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.344 -0.848 . . . . 0.0 109.106 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.5 t -42.25 -56.87 2.76 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.288 0.565 . . . . 0.0 110.463 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -53.87 -45.99 71.16 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 58' ' ' TRP . 51.6 m170 -72.94 121.03 19.4 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.794 0.807 . . . . 0.0 110.127 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -134.45 177.96 7.36 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.843 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.45 140.47 29.78 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.894 -1.129 . . . . 0.0 109.705 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.488 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.49 151.37 48.93 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.35 94.08 4.84 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.064 -1.022 . . . . 0.0 108.659 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.431 ' OE2' ' OE1' ' A' ' 91' ' ' GLN . 10.6 pt-20 -55.4 -23.42 24.61 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.327 -0.858 . . . . 0.0 110.886 -179.147 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.534 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.9 mmtp -69.34 -9.32 52.83 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -133.63 -11.81 2.7 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.068 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.6 45.54 28.43 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -112.36 -172.32 2.02 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.441 0.639 . . . . 0.0 109.798 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.535 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.79 99.65 5.63 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 177.391 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.1 mt -59.88 84.93 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.667 1.222 . . . . 0.0 110.73 -176.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -121.92 10.39 10.17 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -84.66 33.47 0.52 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.512 HG23 ' H ' ' A' ' 42' ' ' GLY . 24.0 m -49.63 -10.01 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 0.0 109.579 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' LYS . 12.8 m80 -55.61 -15.05 2.5 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.187 -0.945 . . . . 0.0 109.89 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -138.07 -122.25 0.13 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.227 -0.921 . . . . 0.0 109.413 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.577 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -151.96 -164.53 2.0 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.15 -1.594 . . . . 0.0 111.11 -178.374 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.566 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.3 mp -71.53 -56.0 6.75 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -43.15 -48.52 6.38 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.667 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.501 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -57.15 -30.41 64.42 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.931 -178.59 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.501 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -88.76 -44.7 10.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.135 -0.978 . . . . 0.0 108.575 179.712 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 111.23 27.24 4.29 Favored Glycine 0 N--CA 1.501 3.005 0 N-CA-C 108.515 -1.834 . . . . 0.0 108.515 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.456 HG22 ' N ' ' A' ' 85' ' ' GLN . 38.8 mt -82.61 160.96 3.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.788 -0.83 . . . . 0.0 109.614 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.456 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.4 tp60 -166.65 -173.3 2.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.439 -0.788 . . . . 0.0 108.894 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.48 -22.65 67.03 Favored 'General case' 0 C--N 1.298 -1.673 0 O-C-N 121.466 -0.771 . . . . 0.0 110.137 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.26 -8.84 59.35 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.098 -179.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.488 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.04 113.73 26.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.562 -0.711 . . . . 0.0 109.099 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -94.43 117.33 29.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.974 -1.079 . . . . 0.0 109.527 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.435 ' HG ' HD12 ' A' ' 20' ' ' LEU . 8.9 mt -95.7 176.89 5.98 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.484 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.9 mt-30 -131.88 168.13 18.39 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -122.38 91.9 3.6 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.3 171.65 7.2 Favored Pre-proline 0 N--CA 1.501 2.091 0 O-C-N 121.65 -0.656 . . . . 0.0 109.834 -177.182 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo . . . . . 0 N--CA 1.493 1.461 0 C-N-CA 122.753 2.302 . . . . 0.0 112.453 179.305 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 22.5 t80 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 542' ' ' HIS . . . . . 0.567 ' CG ' ' H ' ' B' ' 543' ' ' GLU . 17.1 t60 -130.18 -130.7 0.21 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.521 -0.737 . . . . 0.0 109.188 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.567 ' H ' ' CG ' ' B' ' 542' ' ' HIS . 9.6 tt0 64.86 105.37 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 122.481 1.134 . . . . 0.0 109.835 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.523 ' O ' ' C ' ' B' ' 545' ' ' ARG . 21.1 mmt180 -43.7 167.31 0.01 OUTLIER 'General case' 0 C--N 1.288 -2.084 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.752 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.523 ' C ' ' O ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER -6.77 -112.87 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -179.802 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -99.97 -108.23 2.95 Favored Glycine 0 N--CA 1.496 2.667 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -175.68 120.74 0.18 Allowed 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -57.28 135.18 56.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.742 -1.224 . . . . 0.0 110.523 -178.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.549 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.97 103.99 13.67 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.372 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.0 t -49.46 125.86 12.09 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 122.045 0.926 . . . . 0.0 109.786 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.27 -34.77 5.31 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 106.406 -2.678 . . . . 0.0 106.406 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -105.12 -35.75 7.51 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 55.21 56.45 6.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.736 1.255 . . . . 0.0 109.826 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -140.63 123.89 10.14 Favored Pre-proline 0 C--N 1.294 -1.826 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 177.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -43.84 134.42 7.84 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 CA-C-N 120.429 1.189 . . . . 0.0 114.825 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.549 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.5 mt -93.02 99.99 10.58 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 67.1 p -101.45 93.14 5.24 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.241 -0.912 . . . . 0.0 111.22 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.5 -94.35 0.14 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.323 -2.311 . . . . 0.0 107.323 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.471 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -115.88 152.47 33.33 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.78 126.9 15.61 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.981 -1.074 . . . . 0.0 111.5 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 561' ' ' ILE . . . . . 0.488 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 49.6 mt -91.02 146.27 6.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.688 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 9.3 m -121.03 146.25 46.91 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.939 0.876 . . . . 0.0 109.091 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.735 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.83 -128.87 0.26 Allowed 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 5.9 mtp -65.89 26.09 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.569 -0.707 . . . . 0.0 109.11 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.735 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.28 -8.97 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 148.53 27.89 Favored 'General case' 0 C--N 1.306 -1.298 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -94.65 174.8 6.93 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.64 134.96 7.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.442 -1.303 . . . . 0.0 109.929 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.4 m80 -55.91 115.33 9.36 Favored Pre-proline 0 C--N 1.302 -1.473 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.437 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 44.3 Cg_exo -45.75 -11.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.317 1.149 . . . . 0.0 111.586 -178.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.74 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.2 mt-10 -98.3 -52.87 3.52 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 122.102 0.953 . . . . 0.0 110.077 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.48 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.1 m170 -57.04 -4.58 0.19 Allowed 'General case' 0 C--N 1.292 -1.901 0 O-C-N 120.633 -1.292 . . . . 0.0 109.715 -179.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' B' ' 571' ' ' GLU . 14.0 t80 -127.55 54.43 1.68 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.74 HG13 ' O ' ' B' ' 571' ' ' GLU . 13.8 m -93.53 177.58 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 121.624 0.726 . . . . 0.0 110.147 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.659 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.88 141.42 32.24 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.369 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 576' ' ' ALA . . . . . 0.488 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.52 76.41 6.6 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 116.719 -1.992 . . . . 0.0 108.801 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -153.1 -61.52 0.15 Allowed 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 102.498 -3.149 . . . . 0.0 102.498 174.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 20.8 p -120.16 81.57 1.76 Allowed 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 111.647 -2.524 . . . . 0.0 104.803 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.2 mt -53.02 15.48 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.53 -38.15 17.5 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 119.636 -1.915 . . . . 0.0 112.258 -178.547 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.441 ' HA ' HG12 ' B' ' 574' ' ' VAL . 3.4 tp-100 -161.09 142.36 11.69 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 119.673 -1.892 . . . . 0.0 114.341 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.659 HD13 ' HB2' ' B' ' 575' ' ' CYS . 24.0 tp -134.06 171.02 14.79 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 74.0 m-20 -146.77 128.53 15.27 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.186 -0.947 . . . . 0.0 109.468 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.688 ' CE ' ' H ' ' B' ' 562' ' ' THR . 4.5 ptpp? -50.66 -19.41 0.92 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.622 -0.673 . . . . 0.0 110.014 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -85.51 -21.15 55.01 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.894 -1.683 . . . . 0.0 108.894 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -133.75 28.63 3.9 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.69 107.05 18.87 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 122.788 1.28 . . . . 0.0 110.288 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.516 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -100.88 168.46 9.62 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 12.0 tt0 -152.4 157.22 40.93 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.795 -1.191 . . . . 0.0 110.673 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.598 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 1.2 tp-100 -154.15 145.83 23.31 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.493 HD21 ' HG3' ' B' ' 593' ' ' LYS . 0.2 OUTLIER 45.68 23.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.03 -1.044 . . . . 0.0 109.872 -179.719 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.77 -4.85 1.54 Allowed 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.386 0.612 . . . . 0.0 110.482 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 593' ' ' LYS . . . . . 0.493 ' HG3' HD21 ' B' ' 591' ' ' ASN . 37.2 mttm -88.59 121.19 70.24 Favored Pre-proline 0 C--N 1.294 -1.825 0 O-C-N 121.306 -0.871 . . . . 0.0 109.394 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.44 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 49.7 Cg_exo -48.84 164.64 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.22 0 CA-C-N 120.106 1.073 . . . . 0.0 111.782 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' B' ' 588' ' ' LYS . 7.4 m-85 -170.75 142.08 1.91 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.024 -1.048 . . . . 0.0 110.373 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 22.4 m -77.8 154.78 31.57 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -60.58 -58.3 9.07 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -46.17 -26.64 0.81 Allowed 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.675 -0.64 . . . . 0.0 109.484 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.4 m -85.0 -63.9 1.25 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.544 -0.722 . . . . 0.0 109.099 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -52.49 -53.85 40.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.519 -0.738 . . . . 0.0 109.355 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.635 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -49.59 -42.33 44.33 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.52 -24.73 14.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.364 -0.835 . . . . 0.0 109.559 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.8 mt -93.76 -57.21 2.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.251 -0.906 . . . . 0.0 111.685 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.598 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.6 m-85 -87.16 31.5 0.72 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.046 -1.034 . . . . 0.0 110.253 -178.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.943 -1.098 . . . . 0.0 109.447 179.253 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ttt . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 3' ' ' LEU . . . -151.27 -20.65 0.2 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.999 -1.063 . . . . 0.0 109.232 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' A' ' 5' ' ' GLY . 48.5 mt -38.63 -72.45 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 122.449 1.118 . . . . 0.0 109.801 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' CG ' ' O ' ' A' ' 4' ' ' ASP . 21.8 t70 45.26 19.26 0.04 OUTLIER 'General case' 0 C--N 1.289 -2.023 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.585 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 3' ' ' LEU . . . -66.74 -10.61 55.5 Favored Glycine 0 N--CA 1.486 2.018 0 N-CA-C 108.21 -1.956 . . . . 0.0 108.21 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.607 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -108.33 -105.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.962 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.501 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -156.38 -96.85 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 O-C-N 120.376 -1.453 . . . . 0.0 110.597 -179.598 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.501 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -133.29 -53.48 0.03 OUTLIER Pre-proline 0 N--CA 1.509 2.522 0 O-C-N 120.882 -1.136 . . . . 0.0 112.065 -178.673 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -56.71 -34.9 97.12 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 CA-C-N 120.815 1.327 . . . . 0.0 110.094 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -111.43 -26.2 9.22 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.94 -3.02 88.18 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 8' ' ' MET . 0.7 OUTLIER -156.6 -28.85 0.09 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.94 -1.329 . . . . 0.0 110.371 -179.438 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.685 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 84.1 m-85 58.88 -94.41 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.685 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 164.49 -37.68 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.505 -0.747 . . . . 0.0 109.019 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -148.79 1.06 0.57 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.263 -0.898 . . . . 0.0 109.747 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 14.59 57.73 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.557 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -84.61 125.55 32.55 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.118 -1.225 . . . . 0.0 109.44 179.789 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.87 118.96 23.58 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.61 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.06 127.44 32.91 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.068 -1.053 . . . . 0.0 108.368 -179.769 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.493 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -82.82 134.02 35.12 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 179.568 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -76.78 145.66 38.38 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.414 ' N ' ' O ' ' A' ' 31' ' ' VAL . 14.3 t -137.57 105.85 3.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 CA-C-O 121.784 0.802 . . . . 0.0 110.036 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.499 ' NE2' ' OD1' ' A' ' 30' ' ' ASP . 23.7 m80 -82.5 103.53 12.11 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -73.72 120.18 22.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.498 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 p -80.35 -60.51 2.29 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.06 -1.025 . . . . 0.0 111.064 -177.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.435 ' N ' ' OG1' ' A' ' 25' ' ' THR . 14.0 t0 -50.04 -11.01 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.755 -1.215 . . . . 0.0 109.853 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 25' ' ' THR . 2.6 mt -119.13 -37.17 3.24 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' VAL . 21.8 t-20 85.93 8.15 0.33 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 122.364 -0.21 . . . . 0.0 111.555 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.642 ' NH1' HD22 ' A' ' 52' ' ' LEU . 27.5 ptt180 -93.28 -175.75 3.92 Favored 'General case' 0 C--N 1.31 -1.112 0 O-C-N 120.487 -1.383 . . . . 0.0 109.236 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' NE2' ' A' ' 23' ' ' HIS . 20.6 m-20 -131.97 115.81 16.33 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.705 0.764 . . . . 0.0 109.125 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG12 ' N ' ' A' ' 32' ' ' THR . 35.7 t -109.21 157.2 9.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.426 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.5 131.84 40.31 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 179.411 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.426 HD22 ' C ' ' A' ' 32' ' ' THR . 2.1 mm? -113.8 113.08 24.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.617 -0.677 . . . . 0.0 109.291 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.557 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 10.7 tpt180 -60.03 104.17 0.28 Allowed 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.28 -169.54 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 122.119 0.961 . . . . 0.0 110.89 -178.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.414 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.4 p -144.93 172.42 13.06 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.16 43.48 2.25 Favored Glycine 0 N--CA 1.483 1.804 0 N-CA-C 108.921 -1.672 . . . . 0.0 108.921 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.48 ' C ' HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -142.39 3.61 1.53 Allowed 'General case' 0 N--CA 1.486 1.327 0 O-C-N 121.608 -0.936 . . . . 0.0 108.785 179.815 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -90.45 133.4 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.142 -0.974 . . . . 0.0 110.142 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.4 m-70 -76.24 144.2 40.51 Favored 'General case' 0 C--N 1.293 -1.867 0 O-C-N 120.814 -1.179 . . . . 0.0 108.579 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.457 ' C ' ' N ' ' A' ' 43' ' ' GLY . 82.5 mt -49.08 -51.53 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.992 -1.068 . . . . 0.0 109.101 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.55 -15.99 4.84 Favored Glycine 0 N--CA 1.484 1.847 0 N-CA-C 108.283 -1.927 . . . . 0.0 108.283 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.457 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -85.43 -25.85 38.06 Favored Glycine 0 N--CA 1.485 1.935 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 41' ' ' ILE . 38.5 t -81.44 -50.1 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.527 -0.984 . . . . 0.0 109.35 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.418 ' HB2' ' NE2' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -55.67 -41.0 73.04 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.806 -1.184 . . . . 0.0 108.419 179.406 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.59 HD12 HD13 ' B' ' 603' ' ' LEU . 5.8 tt -50.24 -58.56 5.34 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.239 -0.913 . . . . 0.0 109.174 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 48' ' ' LEU . 61.8 mttm -52.13 -54.54 29.36 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.468 -0.77 . . . . 0.0 110.561 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 48' ' ' LEU . 4.0 mm? -45.67 -61.89 1.52 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.547 -1.346 . . . . 0.0 108.822 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 53' ' ' ASP . 97.4 t -52.69 -49.87 44.03 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 O-C-N 121.526 -0.733 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -46.3 -40.61 11.97 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.714 -1.241 . . . . 0.0 109.711 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.425 ' NZ ' HD11 ' A' ' 33' ' ' LEU . 54.5 mttp -69.3 -57.63 5.06 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.322 -0.861 . . . . 0.0 110.325 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.642 HD22 ' NH1' ' A' ' 29' ' ' ARG . 16.2 tp -110.34 41.98 1.65 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.475 1.131 . . . . 0.0 109.56 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.626 ' N ' ' O ' ' A' ' 49' ' ' VAL . 36.4 t0 -52.08 -84.92 0.01 OUTLIER 'General case' 0 C--N 1.263 -3.186 0 CA-C-O 122.232 1.015 . . . . 0.0 109.291 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 55' ' ' LYS . 14.1 p 43.14 179.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.277 -2.569 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.861 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.737 ' H ' HG22 ' A' ' 54' ' ' VAL . 0.7 OUTLIER -77.33 30.49 0.15 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.643 -1.286 . . . . 0.0 108.208 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.621 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 36.7 tttm -79.57 137.42 37.15 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.081 -1.048 . . . . 0.0 109.033 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -50.95 112.44 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.567 -0.708 . . . . 0.0 110.126 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.621 ' CH2' ' NZ ' ' A' ' 56' ' ' LYS . 12.7 m95 -127.44 -21.34 3.85 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.708 0.766 . . . . 0.0 109.788 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.2 t -40.05 -52.79 2.48 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.2 -0.938 . . . . 0.0 111.369 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.426 ' O ' ' O ' ' A' ' 94' ' ' PRO . 17.2 t0 -83.62 13.37 4.68 Favored 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.537 -0.727 . . . . 0.0 110.963 -178.182 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.62 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 3.6 p-80 -71.59 148.75 46.3 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 120.741 -1.224 . . . . 0.0 111.988 -178.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.98 155.22 5.5 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -93.93 148.46 22.13 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.532 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.25 151.52 48.61 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.333 -0.854 . . . . 0.0 108.913 -178.982 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -112.65 94.65 5.01 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.903 . . . . 0.0 108.639 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -55.77 -23.9 32.36 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.245 -0.909 . . . . 0.0 110.872 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.529 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -68.8 -9.03 48.69 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 178.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.56 -12.22 2.7 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.842 -178.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.1 mpp_? 52.43 45.77 27.91 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -113.37 -173.35 2.24 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.673 0.749 . . . . 0.0 110.143 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.32 101.64 7.06 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.721 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' LEU . 34.4 mt -61.74 86.06 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.292 0 O-C-N 120.433 -1.417 . . . . 0.0 110.892 -176.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 8.74 11.39 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.529 ' C ' ' H ' ' A' ' 76' ' ' HIS . 9.5 mmpt? -74.93 58.53 0.85 Allowed 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.1 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.587 HG21 ' O ' ' B' ' 602' ' ' LYS . 0.9 OUTLIER -58.82 -5.95 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.694 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -36.03 -63.44 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.883 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.417 ' HB3' ' H ' ' A' ' 78' ' ' THR . 1.2 t90 -130.78 -100.04 0.31 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.222 -0.924 . . . . 0.0 111.221 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -151.35 -164.38 1.98 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 119.671 -1.893 . . . . 0.0 111.365 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.595 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -68.8 -57.79 5.09 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -42.35 -46.7 4.7 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.499 ' HD2' ' H ' ' A' ' 78' ' ' THR . 0.0 OUTLIER -62.23 -28.93 70.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.909 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.487 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -85.79 -47.4 9.76 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.418 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 113.59 21.71 5.68 Favored Glycine 0 N--CA 1.499 2.854 0 N-CA-C 108.088 -2.005 . . . . 0.0 108.088 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.505 HG22 ' N ' ' A' ' 85' ' ' GLN . 36.4 mt -82.53 161.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.877 -0.778 . . . . 0.0 109.907 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.505 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.7 tp60 -167.76 -163.4 0.49 Allowed 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.37 -27.12 62.18 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.435 -0.791 . . . . 0.0 109.598 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.71 -14.46 62.46 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.463 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.32 113.93 26.51 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -94.67 118.85 32.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.015 -1.053 . . . . 0.0 109.577 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.493 ' HG ' HD12 ' A' ' 20' ' ' LEU . 9.4 mt -96.0 176.94 5.92 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.714 0.768 . . . . 0.0 109.675 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.532 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 10.0 mt-30 -131.13 165.56 23.02 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 58' ' ' TRP . 31.8 t80 -133.8 90.92 2.76 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.66 153.74 39.71 Favored Pre-proline 0 N--CA 1.499 1.987 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.663 -178.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 60' ' ' ASP . 65.4 Cg_endo . . . . . 0 N--CA 1.493 1.479 0 C-N-CA 122.471 2.114 . . . . 0.0 111.444 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -98.95 -63.38 1.13 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.337 -0.852 . . . . 0.0 109.715 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.45 ' O ' ' O ' ' B' ' 544' ' ' ARG . 4.8 pt-20 -90.18 -0.4 57.59 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.258 -0.901 . . . . 0.0 110.041 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.495 ' N ' ' CD ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER 43.68 -169.39 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.309 -0.869 . . . . 0.0 110.305 179.534 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.475 ' N ' ' CD ' ' B' ' 545' ' ' ARG . 0.2 OUTLIER -69.02 -124.24 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.164 -0.96 . . . . 0.0 109.55 -179.805 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -168.12 -92.86 0.09 OUTLIER Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.849 -1.301 . . . . 0.0 109.849 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.552 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m -169.18 120.06 0.72 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.29 -1.124 . . . . 0.0 108.225 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.84 135.21 57.71 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 120.774 -1.204 . . . . 0.0 110.39 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.484 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.72 103.82 13.32 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 178.247 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -50.8 127.05 17.42 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-O 122.14 0.972 . . . . 0.0 109.601 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.68 -34.56 5.4 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 106.043 -2.823 . . . . 0.0 106.043 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -106.04 -35.71 7.17 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.03 56.31 6.73 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 122.663 1.22 . . . . 0.0 109.968 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -140.72 124.17 10.18 Favored Pre-proline 0 C--N 1.293 -1.855 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.4 135.14 9.14 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.452 1.197 . . . . 0.0 114.583 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.552 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.8 mt -93.64 98.49 8.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 557' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.4 p -99.52 91.36 4.87 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.29 -0.881 . . . . 0.0 111.313 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.63 -95.31 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.455 -2.258 . . . . 0.0 107.455 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.478 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.28 151.66 32.55 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.56 126.3 15.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.964 -1.085 . . . . 0.0 111.556 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 561' ' ' ILE . . . . . 0.477 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 46.8 mt -91.29 146.86 5.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.735 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.3 m -117.41 147.06 43.02 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-O 121.888 0.851 . . . . 0.0 109.336 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.29 -129.17 0.26 Allowed 'General case' 0 C--N 1.295 -1.789 0 CA-C-O 121.499 0.666 . . . . 0.0 109.383 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.73 26.13 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.19 -9.03 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.89 163.56 22.17 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -106.1 174.25 5.97 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.14 138.11 9.96 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.33 -1.348 . . . . 0.0 109.813 -179.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.596 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.4 m80 -57.16 116.24 12.98 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 177.1 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.44 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 52.7 Cg_exo -45.13 -10.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.461 0 CA-C-N 120.311 1.147 . . . . 0.0 111.894 -178.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.922 ' O ' HG13 ' B' ' 574' ' ' VAL . 12.4 mt-10 -100.06 -52.42 3.42 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.018 0.913 . . . . 0.0 110.042 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.413 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.5 m170 -58.01 -4.25 0.31 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.864 -1.147 . . . . 0.0 109.81 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.1 t80 -125.91 54.66 1.5 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.922 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.4 m -93.9 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 CA-C-O 121.925 0.869 . . . . 0.0 110.616 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.634 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.29 143.6 31.19 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.626 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.47 74.76 3.29 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 116.672 -2.011 . . . . 0.0 109.84 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 577' ' ' PHE . . . . . 0.593 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 0.3 OUTLIER -153.65 -48.31 0.09 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 102.047 -3.316 . . . . 0.0 102.047 173.244 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.544 ' SG ' ' O ' ' B' ' 578' ' ' CYS . 29.5 p -132.0 81.52 1.97 Allowed 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 176.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.8 mt -53.1 15.65 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.47 -37.38 18.34 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 119.686 -1.884 . . . . 0.0 112.628 -178.255 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.415 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -160.3 140.72 11.69 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 119.596 -1.94 . . . . 0.0 114.448 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.634 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.6 tp -137.77 169.82 17.13 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.5 m-20 -146.22 133.58 20.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.27 -0.894 . . . . 0.0 109.429 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.735 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 2.7 ptpp? -55.38 -14.4 1.89 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.703 0.763 . . . . 0.0 109.518 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -92.9 -16.08 49.61 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -137.31 28.58 2.77 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 3.7 p90 -89.17 111.71 22.55 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 122.304 1.05 . . . . 0.0 109.814 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.56 167.12 10.0 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.873 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.439 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.6 tt0 -152.84 157.56 40.9 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.665 -1.272 . . . . 0.0 110.855 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.439 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 1.3 tp-100 -159.25 146.53 17.18 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 106.214 -1.773 . . . . 0.0 106.214 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.472 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.0 OUTLIER 48.1 22.62 0.43 Allowed 'General case' 0 C--N 1.296 -1.726 0 O-C-N 120.954 -1.091 . . . . 0.0 109.505 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.472 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 80.72 -5.75 1.7 Allowed 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.718 -0.614 . . . . 0.0 110.849 178.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 593' ' ' LYS . . . . . 0.475 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 31.8 mttm -90.5 116.86 67.34 Favored Pre-proline 0 C--N 1.294 -1.824 0 O-C-N 121.22 -0.925 . . . . 0.0 109.483 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.527 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 36.0 Cg_exo -49.52 165.9 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.303 0 CA-C-N 120.026 1.045 . . . . 0.0 112.13 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 42.2 m-85 -170.13 138.68 1.7 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.24 -0.912 . . . . 0.0 109.776 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.3 m -69.57 152.84 44.3 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.343 -2.466 . . . . 0.0 104.343 174.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -57.0 -56.9 15.78 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -45.85 -30.61 1.76 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.462 -0.773 . . . . 0.0 109.731 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 599' ' ' CYS . . . . . 0.593 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 81.0 m -81.23 -60.96 2.09 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.262 -0.898 . . . . 0.0 108.806 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.583 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -57.42 -53.63 55.96 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.124 0.488 . . . . 0.0 110.187 -179.595 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.71 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -49.83 -43.47 48.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.981 -1.074 . . . . 0.0 109.108 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.587 ' O ' HG21 ' A' ' 75' ' ' THR . 60.0 tttt -55.77 -21.06 17.15 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.104 -0.997 . . . . 0.0 109.46 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.59 HD13 HD12 ' A' ' 46' ' ' LEU . 4.8 mt -91.92 -56.75 2.97 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.28 -0.887 . . . . 0.0 110.194 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -98.85 30.25 3.43 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.192 -0.943 . . . . 0.0 109.438 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.493 1.69 0 O-C-N 120.836 -1.165 . . . . 0.0 109.224 179.603 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.412 ' SD ' HD13 ' A' ' 3' ' ' LEU . 35.9 ttm . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.76 -35.37 0.38 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.943 -1.098 . . . . 0.0 108.86 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.926 ' H ' HD12 ' A' ' 3' ' ' LEU . 5.6 mp -59.57 -63.6 1.24 Allowed 'General case' 0 C--N 1.299 -1.587 0 CA-C-O 121.901 0.858 . . . . 0.0 109.248 179.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' C ' HD13 ' A' ' 6' ' ' ILE . 23.2 t0 -91.41 27.47 1.95 Allowed 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' O ' ' C ' ' A' ' 6' ' ' ILE . . . -118.55 -10.09 8.84 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.041 -1.624 . . . . 0.0 109.041 -178.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.522 ' C ' ' O ' ' A' ' 5' ' ' GLY . 0.0 OUTLIER -4.28 -85.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.288 -2.102 0 CA-C-N 113.762 -1.219 . . . . 0.0 112.619 177.888 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.638 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -166.21 -108.6 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.859 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.345 -179.113 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.638 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -154.1 -62.44 0.02 OUTLIER Pre-proline 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.574 -177.011 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -43.15 -44.33 9.82 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 121.208 1.467 . . . . 0.0 110.957 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.415 ' HB3' ' HE ' ' A' ' 7' ' ' ARG . 7.9 t70 -103.8 -20.94 13.76 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.05 -6.56 86.46 Favored Glycine 0 N--CA 1.484 1.848 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 8' ' ' MET . 11.5 t -168.92 -72.77 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.513 -0.992 . . . . 0.0 110.109 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -164.8 -48.41 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.242 -0.911 . . . . 0.0 109.614 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -161.88 -45.87 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.385 -0.822 . . . . 0.0 109.643 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -149.94 5.49 0.58 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.259 -0.901 . . . . 0.0 109.981 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.551 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 106.53 23.25 7.31 Favored Glycine 0 N--CA 1.497 2.715 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.684 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 39.3 p -79.93 130.02 34.96 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.318 -1.107 . . . . 0.0 109.511 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.551 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -148.81 126.09 11.5 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.857 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -81.27 130.21 34.93 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.979 -1.076 . . . . 0.0 109.895 -179.68 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.73 HD11 ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.47 133.03 34.49 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.343 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.46 142.67 39.04 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.017 -1.052 . . . . 0.0 108.595 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 90' ' ' LEU . 24.8 t -136.25 109.93 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 CA-C-O 121.965 0.888 . . . . 0.0 109.992 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 3.6 m80 -85.72 103.84 14.88 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.8 t -72.53 109.95 5.2 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.643 -1.223 . . . . 0.0 107.796 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.462 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -80.38 -39.29 28.69 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.166 -0.959 . . . . 0.0 109.588 -178.86 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 8.7 t0 -67.65 3.15 1.5 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.0 108.89 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.472 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.3 mt -139.63 -28.6 0.76 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.492 -0.755 . . . . 0.0 109.093 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 24.5 t-20 82.55 12.88 0.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 122.124 -0.36 . . . . 0.0 110.432 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.4 mtp-105 -94.87 -178.27 4.45 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.854 -1.154 . . . . 0.0 109.72 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 40.7 m-20 -138.38 115.98 11.35 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.415 HG12 ' N ' ' A' ' 32' ' ' THR . 18.5 t -117.16 157.69 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 CA-C-O 121.666 0.746 . . . . 0.0 110.145 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.451 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.18 130.32 38.99 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.59 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.451 HD22 ' O ' ' A' ' 32' ' ' THR . 2.9 mm? -116.73 115.88 26.47 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.17 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.684 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -61.37 138.48 58.25 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 34' ' ' ARG . 11.5 m -160.33 -169.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.438 0 CA-C-O 121.788 0.804 . . . . 0.0 109.241 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.475 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.7 p -145.18 165.13 29.23 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 178.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -74.16 43.93 1.3 Allowed Glycine 0 C--N 1.292 -1.887 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.499 ' HA ' HG21 ' A' ' 78' ' ' THR . 0.8 OUTLIER -144.27 3.99 1.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.684 -0.892 . . . . 0.0 108.943 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.674 ' O ' HG22 ' A' ' 78' ' ' THR . 3.0 m -90.12 149.51 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.116 -0.99 . . . . 0.0 110.05 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -85.31 142.48 29.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.829 -1.17 . . . . 0.0 108.045 178.791 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 94.3 mt -47.77 -54.9 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.081 -1.012 . . . . 0.0 109.041 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.541 ' H ' HG23 ' A' ' 75' ' ' THR . . . -55.2 -17.04 10.03 Favored Glycine 0 N--CA 1.484 1.882 0 N-CA-C 108.224 -1.95 . . . . 0.0 108.224 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -70.84 -29.31 69.45 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.319 -1.912 . . . . 0.0 108.319 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.26 -36.36 12.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.442 ' HE2' ' HZ3' ' B' ' 602' ' ' LYS . 33.1 mtm -51.29 -37.02 45.21 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.7 tp -69.89 -65.95 0.65 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.461 0.648 . . . . 0.0 110.66 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.9 mtmm -53.81 -55.7 24.17 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.41 -0.806 . . . . 0.0 111.467 -178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.412 HD21 ' CD1' ' A' ' 92' ' ' PHE . 62.2 tp -45.98 -48.67 16.5 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.875 -1.14 . . . . 0.0 109.958 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.9 t -67.8 -46.1 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.972 -1.08 . . . . 0.0 109.633 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -45.28 -38.43 5.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.284 -0.885 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -66.59 -44.69 81.48 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.369 -0.832 . . . . 0.0 109.992 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -60.13 -65.18 0.72 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.011 -1.056 . . . . 0.0 108.361 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.5 t70 76.44 80.83 0.09 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.964 0.887 . . . . 0.0 110.561 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.494 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.32 140.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.633 ' HZ2' HD12 ' B' ' 579' ' ' LEU . 1.8 tptp -69.18 35.67 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.376 -0.827 . . . . 0.0 109.946 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 54' ' ' VAL . 11.6 ttmm -78.44 147.12 34.12 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.989 -1.07 . . . . 0.0 109.024 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.425 ' OD2' ' N ' ' A' ' 57' ' ' ASP . 0.9 OUTLIER -61.86 107.03 0.77 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.537 -0.727 . . . . 0.0 109.377 179.805 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.511 ' O ' ' N ' ' A' ' 61' ' ' HIS . 75.8 m95 -106.42 -35.12 7.2 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.373 -0.83 . . . . 0.0 110.224 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.405 ' C ' ' O ' ' A' ' 58' ' ' TRP . 1.5 t -41.57 -51.21 3.99 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.457 -0.777 . . . . 0.0 109.826 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -56.6 -37.73 71.06 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.511 ' N ' ' O ' ' A' ' 58' ' ' TRP . 8.5 m80 -72.64 134.79 45.28 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-O 121.649 0.738 . . . . 0.0 109.849 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -145.95 174.83 10.92 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.766 HD22 ' N ' ' A' ' 63' ' ' LEU . 2.1 mm? -94.54 141.02 29.08 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.885 -1.134 . . . . 0.0 109.978 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.497 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -125.32 151.12 46.46 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.674 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.541 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.03 93.64 4.58 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.041 -1.037 . . . . 0.0 108.652 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.72 -24.21 21.11 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.179 -0.951 . . . . 0.0 111.043 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.533 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -67.97 -9.44 45.43 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -133.78 -12.53 2.61 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.955 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 52.49 45.74 28.0 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.038 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.0 t -112.13 -171.49 1.86 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.393 0.616 . . . . 0.0 109.697 -178.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.544 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.89 99.14 5.4 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 177.147 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -60.3 83.94 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 122.594 1.188 . . . . 0.0 110.608 -176.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.4 pp -118.97 6.97 11.36 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 178.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.508 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -83.63 57.31 4.01 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.594 HG21 ' O ' ' B' ' 602' ' ' LYS . 5.4 m -49.71 -11.65 0.06 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.056 -1.028 . . . . 0.0 109.126 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.508 ' N ' ' O ' ' A' ' 74' ' ' LYS . 41.1 m80 -64.45 150.06 47.28 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.404 -0.81 . . . . 0.0 109.786 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 78.8 m95 54.98 -129.26 2.16 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.756 -0.59 . . . . 0.0 110.319 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.674 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -156.24 -163.66 1.51 Allowed 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 118.262 -1.375 . . . . 0.0 112.886 -177.935 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.595 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.3 mp -69.03 -56.06 8.92 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -44.82 -46.29 10.6 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.731 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -58.3 -31.24 67.31 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.768 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.519 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -85.11 -46.23 11.32 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.861 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.13 14.32 7.19 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 108.631 -1.787 . . . . 0.0 108.631 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.523 HG22 ' N ' ' A' ' 85' ' ' GLN . 35.8 mt -72.61 161.53 4.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.726 -0.867 . . . . 0.0 109.902 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.523 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.4 tp60 -170.38 -171.97 1.18 Allowed 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.45 -20.02 65.44 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 109.993 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.506 ' OD2' ' N ' ' A' ' 88' ' ' ALA . 46.0 p-10 -79.92 -21.0 44.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.73 ' O ' HD11 ' A' ' 20' ' ' LEU . . . -103.47 112.39 25.27 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.893 ' O ' HD23 ' A' ' 90' ' ' LEU . 4.6 ptpp? -98.41 174.5 6.44 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.035 -1.04 . . . . 0.0 110.317 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.893 HD23 ' O ' ' A' ' 89' ' ' LYS . 2.3 mt -138.13 179.69 6.3 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.913 0.863 . . . . 0.0 109.368 -178.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.482 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.3 mt-30 -129.81 168.55 16.39 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.412 ' CD1' HD21 ' A' ' 48' ' ' LEU . 14.6 t80 -131.39 99.5 4.85 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.91 155.4 30.26 Favored Pre-proline 0 N--CA 1.494 1.753 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.729 -176.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.511 ' HD3' ' CD2' ' A' ' 61' ' ' HIS . 37.2 Cg_exo . . . . . 0 N--CA 1.49 1.305 0 C-N-CA 123.255 2.636 . . . . 0.0 112.744 178.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -75.9 -83.3 0.07 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.245 -0.909 . . . . 0.0 109.641 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' B' ' 544' ' ' ARG . 8.1 pt-20 -134.19 1.48 3.22 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.515 -0.741 . . . . 0.0 109.536 -179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.633 ' CD ' ' H ' ' B' ' 544' ' ' ARG . 0.4 OUTLIER -38.4 136.34 0.68 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.744 -0.598 . . . . 0.0 110.406 -179.555 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -115.03 -51.27 2.73 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.605 -0.684 . . . . 0.0 110.566 -178.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 546' ' ' GLY . . . . . 0.43 ' O ' ' O ' ' B' ' 545' ' ' ARG . . . -56.39 -116.52 0.01 OUTLIER Glycine 0 N--CA 1.491 2.338 0 O-C-N 121.38 -0.825 . . . . 0.0 111.532 -178.05 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.618 ' H ' ' H ' ' B' ' 556' ' ' ILE . 2.4 m -168.92 120.35 0.76 Allowed 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 -178.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.8 mp -56.35 134.97 53.97 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 120.818 -1.176 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.554 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.61 104.26 14.44 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.3 t -49.38 126.08 12.41 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 122.139 0.971 . . . . 0.0 109.89 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.18 -35.95 4.63 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 106.381 -2.688 . . . . 0.0 106.381 -177.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.8 m -103.53 -35.99 8.12 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 55.25 56.07 6.83 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.819 1.295 . . . . 0.0 109.861 -178.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -140.94 124.1 9.93 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -43.57 134.73 7.07 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 CA-C-N 120.461 1.2 . . . . 0.0 114.956 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.618 ' H ' ' H ' ' B' ' 547' ' ' SER . 41.2 mt -92.88 98.3 8.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -98.48 92.54 5.7 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.196 -0.94 . . . . 0.0 111.398 -177.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.56 -96.26 0.16 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 107.421 -2.271 . . . . 0.0 107.421 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.467 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 7.2 mmt180 -114.88 153.09 31.12 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 177.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -144.49 126.79 15.77 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.923 -1.111 . . . . 0.0 111.373 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.3 mt -90.38 146.05 6.67 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.41 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 10.1 m -121.71 146.28 47.18 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 122.008 0.908 . . . . 0.0 109.018 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.712 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.27 -128.73 0.27 Allowed 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.546 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.6 mtt -66.0 26.19 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.531 -0.731 . . . . 0.0 109.081 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.712 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.08 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.46 147.78 28.53 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -94.46 174.59 7.05 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.212 -0.93 . . . . 0.0 108.556 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.9 136.49 7.99 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.767 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.579 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -56.84 116.29 12.78 Favored Pre-proline 0 C--N 1.3 -1.575 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.436 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 39.1 Cg_exo -46.67 -10.2 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.471 0 CA-C-N 120.359 1.164 . . . . 0.0 111.399 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.918 ' O ' HG13 ' B' ' 574' ' ' VAL . 14.0 mt-10 -98.07 -52.08 3.82 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 122.019 0.914 . . . . 0.0 110.066 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.443 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 20.4 m170 -58.64 -4.17 0.39 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 120.949 -1.094 . . . . 0.0 109.764 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.437 ' H ' ' C ' ' B' ' 571' ' ' GLU . 17.0 t80 -128.09 58.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.918 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.31 177.45 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.709 0.766 . . . . 0.0 111.359 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.589 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.48 147.36 35.92 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.84 74.35 3.58 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 116.595 -2.042 . . . . 0.0 110.033 179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -154.14 -65.61 0.14 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 102.436 -3.172 . . . . 0.0 102.436 172.258 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -111.04 82.06 1.53 Allowed 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.296 -2.229 . . . . 0.0 105.238 177.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 0.846 HD22 ' N ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.0 15.4 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -176.677 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.5 -36.66 16.3 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 119.595 -1.941 . . . . 0.0 113.016 -178.275 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 581' ' ' GLN . . . . . . . . . . . . . 3.4 tp-100 -159.76 139.8 11.7 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 119.359 -2.088 . . . . 0.0 115.179 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.1 tp -139.53 168.7 19.22 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.2 m-20 -150.2 133.53 16.41 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.156 -0.965 . . . . 0.0 109.264 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.41 ' HE3' ' H ' ' B' ' 562' ' ' THR . 9.0 ptpt -51.3 -18.11 0.89 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.482 -0.761 . . . . 0.0 109.432 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -19.32 53.11 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 -179.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 586' ' ' THR . . . . . 0.404 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.7 p -134.31 25.58 3.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.559 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.6 109.87 21.02 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.339 1.066 . . . . 0.0 109.897 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.18 159.28 15.68 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 179.647 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.6 tt0 -154.39 156.94 37.77 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.624 1.202 . . . . 0.0 111.147 -178.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.435 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 19.1 pt20 -157.25 145.79 19.57 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.532 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.47 23.82 0.65 Allowed 'General case' 0 C--N 1.289 -2.033 0 O-C-N 121.318 -0.864 . . . . 0.0 109.277 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 83.41 -7.91 1.12 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.915 -0.491 . . . . 0.0 111.958 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -85.72 115.82 63.16 Favored Pre-proline 0 C--N 1.296 -1.738 0 O-C-N 120.966 -1.084 . . . . 0.0 110.763 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 29.1 Cg_exo -53.99 161.92 4.45 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 CA-C-N 120.018 1.042 . . . . 0.0 112.436 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.2 m-85 -171.47 141.68 1.56 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.473 -0.767 . . . . 0.0 109.621 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.0 m -71.21 154.58 41.56 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 104.434 -2.432 . . . . 0.0 104.434 174.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -58.03 -55.32 36.48 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.76 -27.89 1.35 Allowed 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.648 -0.657 . . . . 0.0 109.47 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 52.4 m -85.27 -56.99 3.26 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 2.3 t80 -57.93 -54.23 49.32 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.676 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.06 -39.58 56.33 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.0 108.549 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.594 ' O ' HG21 ' A' ' 75' ' ' THR . 0.7 OUTLIER -54.69 -30.75 56.59 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.533 -0.73 . . . . 0.0 110.036 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.45 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -94.36 -57.48 2.49 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.246 -0.909 . . . . 0.0 111.761 -177.035 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.507 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 5.7 m-85 -88.81 24.58 2.0 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.106 -0.996 . . . . 0.0 110.517 -178.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.507 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 2.3 m . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.029 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttm . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.95 -57.79 0.31 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.96 -1.088 . . . . 0.0 108.476 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.425 ' C ' ' N ' ' A' ' 5' ' ' GLY . 77.7 mt -49.03 -87.57 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 121.947 0.88 . . . . 0.0 109.263 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 20.4 t70 43.98 25.36 0.1 Allowed 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.863 0.84 . . . . 0.0 109.211 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.425 ' N ' ' C ' ' A' ' 3' ' ' LEU . . . -65.27 -14.77 60.05 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.13 -1.988 . . . . 0.0 108.13 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.696 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -111.16 -105.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.281 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.515 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -155.38 -99.05 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.274 0 O-C-N 120.531 -1.356 . . . . 0.0 109.883 -179.581 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.515 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -142.94 -61.56 0.02 OUTLIER Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 120.971 -1.081 . . . . 0.0 110.3 -179.429 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.4 ' C ' ' O ' ' A' ' 8' ' ' MET . 60.3 Cg_exo -43.14 -31.85 2.72 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 CA-C-N 120.941 1.372 . . . . 0.0 109.889 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -117.31 -26.3 6.77 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.704 -1.135 . . . . 0.0 108.057 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.96 5.42 66.01 Favored Glycine 0 N--CA 1.486 2.006 0 N-CA-C 109.209 -1.557 . . . . 0.0 109.209 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.5 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 9.0 t -171.39 -47.43 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.43 -1.041 . . . . 0.0 109.692 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 2.3 t80 82.48 -40.7 0.11 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -179.065 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.673 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 162.34 -40.14 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -161.68 3.21 0.06 Allowed 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.274 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.443 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 79.86 38.79 18.73 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 -179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.1 p -79.19 122.63 26.52 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.622 -0.928 . . . . 0.0 110.218 -179.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.443 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -132.85 122.25 24.14 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.624 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.66 134.72 40.51 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.498 -179.275 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.708 HD21 HG22 ' A' ' 84' ' ' ILE . 0.1 OUTLIER -83.66 131.24 34.96 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.244 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -77.57 145.45 36.85 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.069 -1.019 . . . . 0.0 108.589 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.0 t -139.58 130.63 32.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.445 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 43.5 m80 -105.76 103.99 13.61 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.52 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.1 t -75.06 115.51 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 118.514 -1.274 . . . . 0.0 108.668 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.37 -43.02 21.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.323 -0.861 . . . . 0.0 110.227 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 3.2 p-10 -64.26 -11.33 30.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.929 -1.107 . . . . 0.0 109.48 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 27' ' ' LEU . 3.6 mm? -122.6 -24.16 4.98 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.52 ' N ' ' O ' ' A' ' 24' ' ' VAL . 35.8 t-20 73.03 13.29 4.9 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 -177.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.3 mtp180 -89.02 -177.11 5.38 Favored 'General case' 0 C--N 1.307 -1.264 0 O-C-N 121.195 -0.941 . . . . 0.0 109.455 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.445 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 0.8 OUTLIER -138.45 118.46 13.39 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 178.022 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 20.3 t -118.41 155.93 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.716 0.77 . . . . 0.0 110.486 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.425 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.66 131.12 39.16 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.111 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.447 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 1.8 mm? -114.78 112.94 23.57 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.53 -0.732 . . . . 0.0 109.981 -178.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -60.98 104.99 0.42 Allowed 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.5 m -136.0 -169.12 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 121.857 0.837 . . . . 0.0 110.099 -178.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.1 p -142.62 171.16 14.43 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.25 47.1 2.86 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 108.585 -1.806 . . . . 0.0 108.585 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -146.04 0.25 0.82 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.687 -0.89 . . . . 0.0 108.955 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.569 ' O ' HG22 ' A' ' 78' ' ' THR . 1.6 m -90.2 145.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.179 -0.951 . . . . 0.0 109.447 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.534 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -78.91 133.65 36.92 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 177.975 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -36.45 29.03 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 O-C-N 120.546 -1.347 . . . . 0.0 108.022 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.09 -22.37 49.06 Favored Glycine 0 N--CA 1.484 1.861 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.42 -22.94 78.68 Favored Glycine 0 C--O 1.209 -1.463 0 N-CA-C 108.016 -2.033 . . . . 0.0 108.016 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.19 -33.85 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 61' ' ' HIS . 32.6 mtm -51.97 -39.19 58.93 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.666 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -77.11 -59.97 2.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.746 -0.596 . . . . 0.0 111.457 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -46.37 -56.06 6.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.812 -1.18 . . . . 0.0 110.112 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -46.52 -60.94 2.05 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.02 -1.05 . . . . 0.0 109.76 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 53.1 t -53.25 -47.78 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 120.969 -1.082 . . . . 0.0 110.056 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -45.51 -42.98 11.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.133 -0.979 . . . . 0.0 109.816 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.447 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 55.0 mttp -62.94 -43.02 99.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.374 -0.829 . . . . 0.0 110.162 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.441 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -62.0 -66.72 0.5 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.515 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.87 82.57 0.1 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.994 0.902 . . . . 0.0 110.119 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.513 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.2 p -171.41 141.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.571 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -67.43 32.68 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.427 -0.795 . . . . 0.0 109.671 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.614 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 20.1 ttpp -78.76 139.71 38.38 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.849 -1.157 . . . . 0.0 109.552 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -49.96 118.42 2.89 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.381 -0.824 . . . . 0.0 109.352 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.63 ' O ' ' CG ' ' A' ' 61' ' ' HIS . 61.2 m95 -118.94 -23.62 6.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.484 -0.76 . . . . 0.0 110.431 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.419 ' C ' ' H ' ' A' ' 61' ' ' HIS . 0.3 OUTLIER -44.85 -54.35 6.51 Favored 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.678 -1.264 . . . . 0.0 110.122 -179.206 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 49.0 t0 -59.8 -2.96 0.44 Allowed 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.436 -0.79 . . . . 0.0 110.076 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.63 ' CG ' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -75.12 149.53 39.05 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 -179.446 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.4 ' C ' HD22 ' A' ' 63' ' ' LEU . . . -171.32 151.16 3.04 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -94.65 144.6 25.48 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.49 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.7 143.01 50.84 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.544 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -103.96 91.01 3.79 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.054 -1.029 . . . . 0.0 108.668 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.43 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.62 -22.62 14.04 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.227 -0.92 . . . . 0.0 111.205 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.46 ' HB2' ' NE1' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -64.43 -21.77 66.75 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 178.312 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.541 ' C ' HH21 ' A' ' 69' ' ' ARG . 15.3 mmtt -120.67 -12.09 8.93 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.38 -178.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.544 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.0 OUTLIER 52.9 46.53 26.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.006 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.58 -174.14 2.41 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.409 0.623 . . . . 0.0 110.125 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.527 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.57 98.39 5.01 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 177.385 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.18 92.31 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 123.04 1.4 . . . . 0.0 110.121 -176.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -125.71 6.21 7.46 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.006 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -82.59 39.83 0.63 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.463 HG21 ' HD2' ' B' ' 602' ' ' LYS . 13.9 p -46.26 -15.11 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.078 -1.014 . . . . 0.0 110.127 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 7.9 m80 -79.27 43.42 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.154 -0.966 . . . . 0.0 110.253 -179.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -176.86 -142.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.025 -1.047 . . . . 0.0 108.573 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.569 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -152.58 166.34 32.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 119.736 -1.853 . . . . 0.0 111.261 -178.761 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.529 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 6.5 mp -44.76 -59.02 2.72 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -45.64 -36.85 5.13 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.157 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.539 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -62.85 -35.71 80.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.031 -1.068 . . . . 0.0 108.573 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.539 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -92.71 -38.84 11.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.016 -1.053 . . . . 0.0 108.426 178.881 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.85 12.63 8.38 Favored Glycine 0 N--CA 1.5 2.912 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.708 HG22 HD21 ' A' ' 20' ' ' LEU . 68.1 mt -61.04 156.61 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.433 -1.04 . . . . 0.0 108.519 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.462 ' H ' ' HB3' ' A' ' 88' ' ' ALA . 1.4 tp60 -170.77 -174.81 1.66 Allowed 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.74 -25.13 66.25 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.374 -0.829 . . . . 0.0 109.803 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -81.14 -6.08 58.42 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.36 112.82 24.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.691 -0.631 . . . . 0.0 109.451 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.0 mmtp -97.66 116.25 29.51 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.117 -0.989 . . . . 0.0 109.255 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.6 mt -99.62 177.81 5.04 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.627 0.727 . . . . 0.0 109.698 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.49 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 7.6 mt-30 -129.84 167.02 18.78 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -133.49 95.62 3.54 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.22 157.03 79.23 Favored Pre-proline 0 N--CA 1.503 2.217 0 O-C-N 121.944 -0.472 . . . . 0.0 111.275 -176.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo . . . . . 0 N--CA 1.497 1.73 0 C-N-CA 122.969 2.446 . . . . 0.0 111.758 178.74 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -71.53 -100.69 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.234 -0.916 . . . . 0.0 109.667 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.519 ' O ' ' O ' ' B' ' 544' ' ' ARG . 5.3 pt-20 -143.82 -4.14 0.86 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.238 -0.914 . . . . 0.0 110.153 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.519 ' O ' ' O ' ' B' ' 543' ' ' GLU . 0.2 OUTLIER 52.87 120.99 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.812 0.815 . . . . 0.0 110.808 179.281 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.42 ' H ' ' HG2' ' B' ' 545' ' ' ARG . 22.0 mmt180 -45.64 -93.4 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.967 -1.083 . . . . 0.0 109.909 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -157.56 -105.71 0.22 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.524 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.6 m -159.27 116.6 2.72 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -61.36 135.82 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.021 -1.049 . . . . 0.0 110.346 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.504 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.32 103.51 12.76 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 178.34 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.7 t -50.8 126.54 16.12 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 122.144 0.974 . . . . 0.0 109.527 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.12 5.63 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 106.301 -2.719 . . . . 0.0 106.301 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -106.45 -35.44 7.1 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.28 56.63 6.21 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 122.659 1.219 . . . . 0.0 109.972 -178.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -140.6 123.55 9.99 Favored Pre-proline 0 C--N 1.294 -1.845 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -44.41 135.81 8.86 Favored 'Trans proline' 0 N--CA 1.494 1.502 0 CA-C-N 120.509 1.217 . . . . 0.0 114.58 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.524 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -95.19 98.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.8 p -100.91 91.26 4.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.212 -0.93 . . . . 0.0 111.211 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.76 -95.21 0.14 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.356 -2.298 . . . . 0.0 107.356 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.6 mmt-85 -113.4 150.25 32.97 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.4 p -144.71 126.41 15.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.971 -1.081 . . . . 0.0 111.509 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.34 146.74 5.87 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.8 m -118.48 146.63 44.35 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.761 0.791 . . . . 0.0 108.934 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.737 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.17 -129.39 0.26 Allowed 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 121.604 0.716 . . . . 0.0 109.352 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.564 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.8 mtt -65.97 26.42 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.737 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.42 -9.04 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 -178.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.1 mtmt -82.17 162.73 22.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt -105.62 174.52 5.85 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -161.21 136.25 7.52 Favored 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.969 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -55.49 114.7 7.74 Favored Pre-proline 0 C--N 1.301 -1.531 0 N-CA-C 105.525 -2.028 . . . . 0.0 105.525 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.455 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 45.2 Cg_exo -45.67 -12.84 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.527 0 CA-C-N 120.237 1.12 . . . . 0.0 111.408 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.855 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.0 mt-10 -95.73 -52.71 3.98 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.988 0.899 . . . . 0.0 110.252 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.438 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.2 m170 -58.35 -4.0 0.33 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.986 -1.071 . . . . 0.0 109.876 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.448 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.4 t80 -128.93 56.35 1.68 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 178.415 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.855 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.0 178.02 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.814 0.816 . . . . 0.0 110.898 -178.664 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.648 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.41 143.82 30.03 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.74 73.61 5.79 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.505 -2.078 . . . . 0.0 108.905 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 577' ' ' PHE . . . . . 0.447 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 34.9 t80 -154.56 -60.13 0.12 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 102.858 -3.016 . . . . 0.0 102.858 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' B' ' 580' ' ' LYS . 31.9 p -113.96 79.12 1.21 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.534 -2.121 . . . . 0.0 105.413 176.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 0.452 HD23 ' N ' ' B' ' 579' ' ' LEU . 5.9 mt -51.36 14.7 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.019 -0.992 . . . . 0.0 113.272 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -97.11 -36.84 10.35 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.045 -1.66 . . . . 0.0 112.652 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.455 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.4 tp-100 -159.18 140.93 13.38 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 119.617 -1.927 . . . . 0.0 114.636 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.648 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.2 tp -134.51 169.97 16.47 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.427 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.5 m-20 -145.49 128.16 16.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.335 -0.853 . . . . 0.0 109.073 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -51.2 -21.53 2.09 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.57 -0.707 . . . . 0.0 109.689 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.12 -19.81 60.25 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.56 28.46 3.97 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.569 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.07 105.72 17.97 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 122.932 1.349 . . . . 0.0 110.088 -179.634 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.528 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -97.51 167.76 10.79 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.5 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.8 tt0 -152.61 157.37 40.9 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.558 1.17 . . . . 0.0 110.711 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.629 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.9 OUTLIER -155.35 146.04 22.23 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 178.773 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.47 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.2 OUTLIER 45.86 23.51 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.012 -1.055 . . . . 0.0 109.991 -179.701 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.68 -5.11 1.55 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.715 -0.615 . . . . 0.0 111.078 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 32.6 mttm -89.61 123.17 67.26 Favored Pre-proline 0 C--N 1.295 -1.8 0 O-C-N 121.161 -0.962 . . . . 0.0 109.241 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.486 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.8 Cg_exo -48.63 163.94 0.25 Allowed 'Trans proline' 0 N--CA 1.489 1.243 0 CA-C-N 120.051 1.054 . . . . 0.0 111.941 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' B' ' 588' ' ' LYS . 11.3 m-85 -170.34 138.43 1.58 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.017 -1.052 . . . . 0.0 110.685 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 39.5 m -75.38 157.39 34.27 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 174.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -61.03 -56.69 18.01 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 117.53 -1.668 . . . . 0.0 106.618 178.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.17 -27.29 0.94 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.582 -0.698 . . . . 0.0 109.552 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 87.9 m -85.06 -59.28 2.38 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.484 -0.76 . . . . 0.0 109.01 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -54.69 -49.48 70.56 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.706 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -55.73 -40.27 72.25 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.463 ' HD2' HG21 ' A' ' 75' ' ' THR . 0.2 OUTLIER -51.14 -28.32 10.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.756 . . . . 0.0 109.52 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.666 HD13 HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -94.08 -57.48 2.52 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.233 -0.917 . . . . 0.0 112.051 -176.947 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.629 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 14.6 m-85 -92.23 22.12 4.69 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.809 -1.182 . . . . 0.0 110.598 -178.205 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.52 ' O ' ' CE1' ' A' ' 76' ' ' HIS . 2.2 m . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.109 -0.995 . . . . 0.0 108.952 179.067 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.634 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.634 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -151.22 -53.0 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.566 ' C ' ' H ' ' A' ' 5' ' ' GLY . 54.0 mt -46.84 -81.19 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.791 0.805 . . . . 0.0 109.309 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.447 ' OD2' HD11 ' A' ' 6' ' ' ILE . 10.7 t0 60.43 -6.36 0.09 Allowed 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.931 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.566 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 117.99 -13.12 12.88 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 107.906 -2.078 . . . . 0.0 107.906 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.624 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -120.52 -108.14 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 -179.212 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.598 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -168.06 -102.06 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 O-C-N 120.835 -1.165 . . . . 0.0 109.434 179.851 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.598 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -150.68 -64.26 0.02 OUTLIER Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.087 -1.008 . . . . 0.0 110.986 -179.182 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -44.61 -41.36 14.41 Favored 'Trans proline' 0 N--CA 1.493 1.5 0 CA-C-N 121.262 1.487 . . . . 0.0 110.894 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -105.81 -33.73 7.89 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.253 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.11 4.39 58.48 Favored Glycine 0 N--CA 1.482 1.749 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.407 ' N ' ' O ' ' A' ' 8' ' ' MET . 6.9 t -162.36 -76.89 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.561 -0.964 . . . . 0.0 109.341 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.441 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 0.2 OUTLIER -174.02 -60.23 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.257 -0.902 . . . . 0.0 108.76 -179.889 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 176.1 -47.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -147.93 3.84 0.73 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.567 -0.708 . . . . 0.0 109.2 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.69 26.22 10.04 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.648 -1.781 . . . . 0.0 108.648 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 p -97.91 122.07 40.58 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.661 -0.905 . . . . 0.0 109.771 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -127.92 130.11 47.94 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.484 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.612 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -82.98 135.72 34.78 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.189 -0.944 . . . . 0.0 110.013 -179.358 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.48 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.72 131.33 34.58 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.98 144.55 36.65 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 120.9 -1.125 . . . . 0.0 108.326 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.8 t -139.18 108.58 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.749 0.785 . . . . 0.0 110.314 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 14.0 m80 -82.49 105.98 13.99 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.537 ' O ' ' N ' ' A' ' 28' ' ' ASN . 5.4 t -73.45 111.18 7.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 118.807 -1.157 . . . . 0.0 109.607 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.487 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.1 p -76.87 165.58 24.5 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.8 t70 72.81 -44.57 0.6 Allowed 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.506 HD22 ' HD2' ' A' ' 29' ' ' ARG . 5.7 mt -94.25 -31.37 14.12 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' VAL . 31.6 t-20 70.93 17.6 6.25 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.804 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.506 ' HD2' HD22 ' A' ' 27' ' ' LEU . 1.0 OUTLIER -89.13 -179.59 5.93 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.698 -1.251 . . . . 0.0 108.872 179.54 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 3.1 m-20 -139.91 115.41 9.99 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 17.3 t -115.25 157.41 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 CA-C-O 121.536 0.684 . . . . 0.0 109.966 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.483 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 132.76 42.03 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.483 HD22 ' C ' ' A' ' 32' ' ' THR . 3.7 mm? -115.53 112.91 22.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.636 -0.665 . . . . 0.0 110.372 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.65 109.1 0.95 Allowed 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.53 -169.27 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 CA-C-O 121.815 0.817 . . . . 0.0 110.218 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.7 p -143.64 174.55 10.69 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.73 44.01 3.04 Favored Glycine 0 N--CA 1.483 1.801 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.452 ' C ' HG21 ' A' ' 78' ' ' THR . 4.2 pt-20 -145.37 3.82 1.02 Allowed 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.592 ' O ' HG22 ' A' ' 78' ' ' THR . 2.4 m -89.16 143.3 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 120.92 -1.113 . . . . 0.0 110.072 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.511 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -80.16 141.83 35.33 Favored 'General case' 0 C--N 1.293 -1.881 0 O-C-N 120.888 -1.133 . . . . 0.0 108.126 178.794 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.464 ' C ' ' N ' ' A' ' 43' ' ' GLY . 19.6 mt -47.27 -58.32 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.047 -1.033 . . . . 0.0 109.495 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.406 ' H ' HG23 ' A' ' 75' ' ' THR . . . -54.38 -13.59 4.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.023 -2.031 . . . . 0.0 108.023 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.6 -28.47 67.36 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.95 -35.58 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.7 mtm -51.02 -37.72 46.91 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.606 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -70.32 -63.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.836 -0.54 . . . . 0.0 109.843 -179.192 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.429 ' HB2' HD12 ' A' ' 33' ' ' LEU . 32.8 mttt -53.34 -56.54 15.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.942 . . . . 0.0 111.37 -178.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.466 HD21 ' CD2' ' A' ' 92' ' ' PHE . 53.6 tp -45.46 -34.15 3.03 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.846 -1.159 . . . . 0.0 110.215 -177.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 19.4 t -80.46 -44.12 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.985 -1.072 . . . . 0.0 109.114 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -43.11 -33.89 0.96 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.527 0.679 . . . . 0.0 109.969 -178.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mtmt -83.72 -39.76 19.73 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.539 -0.726 . . . . 0.0 110.43 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.431 HD23 ' CG1' ' A' ' 54' ' ' VAL . 10.9 tp -51.23 -60.58 2.96 Favored 'General case' 0 N--CA 1.484 1.249 0 O-C-N 121.133 -0.979 . . . . 0.0 108.969 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 68.73 78.83 0.22 Allowed 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.861 0.838 . . . . 0.0 110.424 178.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.514 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -173.78 142.07 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.463 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.1 tttt -71.28 39.81 0.06 Allowed 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.554 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.7 ttmm -77.47 154.15 32.84 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.53 91.2 7.36 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 0.1 OUTLIER -80.59 -44.17 19.39 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 122.129 0.966 . . . . 0.0 109.015 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.499 ' C ' ' H ' ' A' ' 61' ' ' HIS . 58.4 p -39.82 -55.31 1.99 Allowed 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.166 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -52.41 -8.05 0.07 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.191 -0.943 . . . . 0.0 109.517 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.7 OUTLIER -98.27 173.32 7.05 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 122.319 1.057 . . . . 0.0 110.771 -179.233 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' CD2' ' A' ' 61' ' ' HIS . . . -168.19 162.18 12.73 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.822 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.4 mm? -94.75 145.9 24.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.182 -0.949 . . . . 0.0 109.347 -179.274 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.478 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.11 148.53 50.58 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -106.08 91.07 3.57 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.056 -1.027 . . . . 0.0 108.527 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.406 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.1 pt-20 -55.64 -21.77 19.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.064 -1.023 . . . . 0.0 111.037 -178.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.499 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -66.07 -17.73 64.89 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -125.97 -11.92 6.49 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.623 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.0 mpp_? 53.69 46.41 25.97 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 -177.726 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -113.03 -171.62 1.9 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.365 0.602 . . . . 0.0 109.851 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.552 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.34 99.46 5.43 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.496 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -60.36 82.28 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.926 0 CA-C-O 122.372 1.082 . . . . 0.0 110.673 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -118.33 5.74 11.86 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.414 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.48 55.54 2.32 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.539 HG21 ' O ' ' B' ' 602' ' ' LYS . 12.6 m -47.77 -25.06 1.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.047 -1.033 . . . . 0.0 109.218 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.1 158.32 13.99 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.487 -0.758 . . . . 0.0 109.461 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 45.1 m95 57.34 -138.16 0.94 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.662 -0.649 . . . . 0.0 110.05 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.592 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -155.63 -162.8 1.38 Allowed 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.527 -1.269 . . . . 0.0 111.583 -179.055 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.609 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.6 mp -72.46 -56.34 5.57 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -43.02 -49.41 6.07 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.629 -1.168 . . . . 0.0 111.188 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.54 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -56.63 -30.6 63.47 Favored 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.475 -178.3 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.54 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -82.88 -49.0 10.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.848 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 118.11 7.83 11.05 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.161 -1.976 . . . . 0.0 108.161 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.444 HG22 ' N ' ' A' ' 85' ' ' GLN . 30.3 mt -60.66 161.36 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.502 ' HA ' ' CZ3' ' A' ' 18' ' ' TRP . 1.0 OUTLIER -155.75 -163.06 1.42 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.962 -1.086 . . . . 0.0 109.64 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.88 -24.18 59.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.49 -0.756 . . . . 0.0 110.75 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -84.77 3.17 38.81 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.43 -0.794 . . . . 0.0 109.756 -178.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.48 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -91.72 112.68 24.7 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.543 -0.723 . . . . 0.0 109.332 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -97.78 117.87 33.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.92 -1.113 . . . . 0.0 109.894 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.419 ' HG ' HD12 ' A' ' 20' ' ' LEU . 2.5 mt -103.6 178.01 4.68 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.478 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.7 mt-30 -131.52 157.92 42.28 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -122.79 93.4 3.95 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.817 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.57 149.54 41.82 Favored Pre-proline 0 N--CA 1.504 2.229 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.361 -178.467 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo . . . . . 0 N--CA 1.496 1.666 0 C-N-CA 122.547 2.165 . . . . 0.0 111.907 179.477 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 541' ' ' TYR . . . . . 0.436 ' O ' ' O ' ' B' ' 542' ' ' HIS . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 542' ' ' HIS . . . . . 0.436 ' O ' ' O ' ' B' ' 541' ' ' TYR . 71.2 m80 -61.92 -140.78 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.262 -0.899 . . . . 0.0 109.498 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.421 ' O ' ' C ' ' B' ' 544' ' ' ARG . 20.1 pt-20 -173.62 -24.82 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.23 -0.919 . . . . 0.0 110.102 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.494 ' N ' ' CD ' ' B' ' 544' ' ' ARG . 0.3 OUTLIER 39.88 88.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.572 -0.705 . . . . 0.0 110.3 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 545' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -59.14 -77.38 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.378 -0.826 . . . . 0.0 110.294 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -120.83 -90.64 1.16 Allowed Glycine 0 N--CA 1.501 3.017 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.538 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -174.3 122.45 0.29 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.244 -1.151 . . . . 0.0 108.223 -178.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.26 136.17 57.95 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.627 -1.296 . . . . 0.0 110.474 -178.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.512 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.4 OUTLIER -83.89 103.51 13.22 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 178.094 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.4 t -52.11 128.83 25.89 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 122.315 1.055 . . . . 0.0 110.872 -176.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.71 -25.43 28.34 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 106.433 -2.667 . . . . 0.0 106.433 -178.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 2.0 t -112.78 -29.99 7.22 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 553' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' B' ' 549' ' ' CYS . 15.4 mm100 46.88 57.46 5.61 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 122.525 1.155 . . . . 0.0 112.779 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -142.51 125.92 9.47 Favored Pre-proline 0 C--N 1.286 -2.184 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -44.34 134.94 9.05 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 CA-C-N 120.412 1.183 . . . . 0.0 114.596 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.4 mt -94.37 98.04 7.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 5.3 p -100.54 90.94 4.45 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.273 -0.892 . . . . 0.0 111.194 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.11 -96.33 0.16 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.483 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.0 mmt-85 -110.83 150.54 29.0 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 178.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.73 126.26 15.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 111.677 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.27 146.49 6.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 178.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.434 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 8.9 m -119.93 146.45 45.79 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.803 0.811 . . . . 0.0 109.02 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.21 -129.29 0.27 Allowed 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.517 0.675 . . . . 0.0 109.538 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.56 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 13.7 mtm -66.09 26.57 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.62 -9.38 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 566' ' ' LYS . . . . . 0.451 ' NZ ' ' CE ' ' B' ' 564' ' ' MET . 13.1 mtmt -81.53 161.14 23.7 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -103.29 174.4 5.88 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.11 134.9 7.74 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.207 -1.397 . . . . 0.0 109.911 -179.115 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.556 ' O ' ' N ' ' B' ' 571' ' ' GLU . 4.4 m80 -55.84 114.9 8.28 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 176.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.451 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.22 -12.49 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.534 0 CA-C-N 120.47 1.204 . . . . 0.0 110.703 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.844 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.5 mt-10 -94.57 -52.46 4.3 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.046 0.927 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.458 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -60.67 -3.67 0.77 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.958 -1.089 . . . . 0.0 109.812 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.414 ' H ' ' C ' ' B' ' 571' ' ' GLU . 25.5 t80 -128.84 55.78 1.7 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.844 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.4 m -94.52 178.2 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-O 121.85 0.833 . . . . 0.0 111.24 -178.398 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.658 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.8 142.59 30.54 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.76 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -92.6 75.22 5.07 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 116.717 -1.993 . . . . 0.0 109.289 178.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -153.05 -51.58 0.1 Allowed 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 102.413 -3.18 . . . . 0.0 102.413 173.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.553 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.1 p -129.64 80.53 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.94 -2.391 . . . . 0.0 105.299 177.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.85 15.1 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -176.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.553 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.99 -37.22 16.54 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 119.733 -1.854 . . . . 0.0 112.112 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.451 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.3 tp-100 -160.13 139.82 11.23 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 119.624 -1.923 . . . . 0.0 114.907 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.8 tp -135.81 169.35 17.7 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 71.2 m-20 -142.53 143.34 32.46 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.333 -0.855 . . . . 0.0 108.891 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.434 ' HE3' ' H ' ' B' ' 562' ' ' THR . 11.4 ptpt -64.14 -17.24 63.28 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.478 -0.763 . . . . 0.0 109.773 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.59 -17.14 55.56 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.08 27.14 4.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.933 -0.745 . . . . 0.0 109.363 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.517 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -88.72 111.24 21.74 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.593 1.187 . . . . 0.0 109.331 179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.514 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.76 168.89 8.95 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.8 tt0 -151.84 157.07 41.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.729 -1.232 . . . . 0.0 110.797 -178.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.469 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 2.5 tp60 -158.59 146.45 18.12 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 178.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.24 22.56 0.45 Allowed 'General case' 0 C--N 1.295 -1.783 0 O-C-N 120.911 -1.118 . . . . 0.0 109.547 -179.434 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 0.8 OUTLIER 79.44 -3.69 2.08 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.732 -0.605 . . . . 0.0 110.933 178.519 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -91.03 125.44 58.74 Favored Pre-proline 0 C--N 1.294 -1.81 0 O-C-N 121.265 -0.897 . . . . 0.0 109.39 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.6 Cg_exo -48.87 165.77 0.17 Allowed 'Trans proline' 0 N--CA 1.492 1.404 0 CA-C-N 120.15 1.089 . . . . 0.0 111.955 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.0 m-85 -171.1 136.89 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.9 -1.125 . . . . 0.0 111.066 -178.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 23.3 m -73.05 154.55 40.4 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -59.77 -58.14 9.85 Favored 'General case' 0 C--N 1.288 -2.081 0 C-N-CA 117.525 -1.67 . . . . 0.0 106.582 179.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -46.04 -26.17 0.69 Allowed 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -85.36 -64.48 1.15 Allowed 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.533 -0.73 . . . . 0.0 109.389 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -50.98 -53.56 32.06 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.847 . . . . 0.0 108.856 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.719 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -50.51 -41.87 54.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.539 ' O ' HG21 ' A' ' 75' ' ' THR . 0.2 OUTLIER -53.38 -24.42 12.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.452 -0.78 . . . . 0.0 109.087 179.558 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.606 HD13 HD12 ' A' ' 46' ' ' LEU . 3.6 mt -94.16 -56.97 2.66 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.281 -0.887 . . . . 0.0 111.5 -178.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.515 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 51.7 m-85 -105.1 -28.49 10.98 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.136 -0.978 . . . . 0.0 110.953 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.2 p . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.949 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ttt . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -158.76 -49.33 0.06 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.098 -1.001 . . . . 0.0 109.138 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.564 ' C ' ' H ' ' A' ' 5' ' ' GLY . 57.5 mt -44.09 -78.14 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 121.945 0.879 . . . . 0.0 109.792 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.457 ' OD1' HD11 ' A' ' 6' ' ' ILE . 7.5 t0 60.81 -6.56 0.09 Allowed 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.679 -179.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.564 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 116.96 -12.57 14.62 Favored Glycine 0 N--CA 1.492 2.423 0 N-CA-C 108.029 -2.028 . . . . 0.0 108.029 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.636 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -118.48 -109.14 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 -179.129 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.5 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -157.61 -95.1 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 O-C-N 120.392 -1.442 . . . . 0.0 110.439 -179.485 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.5 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -131.05 -54.0 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.567 0 O-C-N 120.96 -1.087 . . . . 0.0 111.685 -179.004 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -55.04 -33.43 83.33 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 CA-C-N 121.078 1.421 . . . . 0.0 110.242 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -114.16 -26.59 7.99 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -82.72 4.92 77.2 Favored Glycine 0 N--CA 1.484 1.866 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.51 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 10.2 t -163.56 -44.17 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.207 -1.172 . . . . 0.0 109.716 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.678 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 8.2 t80 88.41 -79.98 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.678 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 164.87 -37.14 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.472 -0.768 . . . . 0.0 108.993 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -135.48 0.51 2.77 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 18' ' ' TRP . . . 62.81 44.39 97.54 Favored Glycine 0 N--CA 1.488 2.165 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.574 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -76.92 126.55 31.16 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.416 -1.05 . . . . 0.0 110.379 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.4 ' CD2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -130.68 119.76 22.88 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 177.89 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.9 127.83 33.9 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.11 -1.036 . . . . 0.0 109.008 -179.375 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.54 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -83.52 134.3 34.84 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 179.447 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 t -78.21 145.68 35.4 Favored 'General case' 0 C--N 1.294 -1.822 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.433 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.5 t -136.81 105.3 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 CA-C-O 121.817 0.817 . . . . 0.0 109.525 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.53 ' CD2' ' OD2' ' A' ' 30' ' ' ASP . 12.1 m80 -78.79 103.71 8.92 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 178.253 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.5 t -72.28 113.3 9.23 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 118.613 -1.235 . . . . 0.0 107.972 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.477 ' C ' ' H ' ' A' ' 27' ' ' LEU . 30.3 p -80.84 -36.94 30.83 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.392 -0.817 . . . . 0.0 109.873 -178.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -71.34 9.55 0.77 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.946 -1.096 . . . . 0.0 108.654 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.9 mt -147.06 -29.07 0.37 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.585 -0.697 . . . . 0.0 109.294 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 24' ' ' VAL . 26.9 t-20 80.78 12.5 0.84 Allowed 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -94.29 -178.26 4.54 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.997 -1.065 . . . . 0.0 109.495 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.53 ' OD2' ' CD2' ' A' ' 23' ' ' HIS . 3.5 m-20 -136.0 114.99 12.24 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 25.8 t -112.35 157.59 13.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.493 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -132.46 133.99 44.53 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.493 HD22 ' C ' ' A' ' 32' ' ' THR . 3.6 mm? -113.76 113.01 24.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.645 -0.659 . . . . 0.0 109.695 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.574 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 14.7 tpt180 -60.12 102.38 0.16 Allowed 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 23.8 m -132.96 -169.75 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 CA-C-O 121.918 0.866 . . . . 0.0 110.854 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.3 p -145.26 176.43 9.55 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.33 46.58 3.04 Favored Glycine 0 C--N 1.295 -1.729 0 N-CA-C 109.153 -1.579 . . . . 0.0 109.153 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.439 ' C ' HG21 ' A' ' 78' ' ' THR . 4.2 pt-20 -147.01 0.23 0.72 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.203 -1.175 . . . . 0.0 108.669 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 m -89.76 128.21 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 120.97 -1.081 . . . . 0.0 109.691 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 43' ' ' GLY . 7.6 m80 -66.92 144.15 56.41 Favored 'General case' 0 C--N 1.291 -1.957 0 O-C-N 121.001 -1.062 . . . . 0.0 108.887 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.519 HD13 ' HB3' ' A' ' 72' ' ' LEU . 96.4 mt -46.22 -56.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.194 -0.941 . . . . 0.0 109.365 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.591 ' H ' HG23 ' A' ' 75' ' ' THR . . . -57.24 -14.86 13.0 Favored Glycine 0 C--N 1.296 -1.661 0 N-CA-C 108.741 -1.744 . . . . 0.0 108.741 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.29 -18.69 77.86 Favored Glycine 0 N--CA 1.485 1.905 0 N-CA-C 109.131 -1.588 . . . . 0.0 109.131 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 t -83.41 -50.76 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.385 -1.068 . . . . 0.0 109.063 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.6 mtm -50.41 -39.66 47.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.867 -1.145 . . . . 0.0 108.542 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.704 HD12 HD13 ' B' ' 603' ' ' LEU . 6.7 tt -56.98 -53.87 53.19 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.41 ' CB ' HD12 ' A' ' 33' ' ' LEU . 55.1 mttm -67.27 -52.84 35.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.12 -0.988 . . . . 0.0 110.7 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.1 tp -44.77 -40.48 6.11 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.142 -0.974 . . . . 0.0 110.163 -178.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.5 t -78.07 -45.68 27.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.927 -1.108 . . . . 0.0 109.952 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -44.67 -37.43 3.67 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.349 -0.844 . . . . 0.0 109.831 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.523 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.8 mtmp? -75.87 -39.04 57.25 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.46 -0.775 . . . . 0.0 110.775 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.442 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -62.03 -67.56 0.4 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.039 -1.038 . . . . 0.0 109.089 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.76 80.83 0.1 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.97 0.891 . . . . 0.0 110.142 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.497 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.3 p -172.52 142.06 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -68.04 31.83 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.0 110.833 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.497 ' H ' ' C ' ' A' ' 54' ' ' VAL . 1.6 tppp? -79.86 142.15 35.49 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.859 -1.151 . . . . 0.0 108.268 178.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -60.0 115.77 3.67 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.477 -0.765 . . . . 0.0 110.03 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.424 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 71.2 m95 -119.67 -43.79 2.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.569 -0.707 . . . . 0.0 109.788 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -48.67 -56.04 9.63 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.954 -1.091 . . . . 0.0 110.094 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.62 -36.84 47.46 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.133 -0.979 . . . . 0.0 108.904 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.408 ' O ' ' CZ ' ' A' ' 92' ' ' PHE . 14.7 m170 -72.49 128.02 34.34 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.888 0.851 . . . . 0.0 110.586 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.68 160.11 27.89 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.496 ' HA ' ' O ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER -99.7 148.63 24.16 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-O 122.274 1.035 . . . . 0.0 110.031 -178.65 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.47 ' CD1' ' C ' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.07 151.28 48.83 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.191 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.647 ' HB2' HD21 ' A' ' 72' ' ' LEU . 5.2 t90 -100.73 90.5 4.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.8 -1.188 . . . . 0.0 108.674 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.416 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 9.2 pt-20 -54.59 -23.17 15.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.17 -0.956 . . . . 0.0 110.91 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.504 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 15.7 mmtp -67.48 -10.7 53.97 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -133.93 -11.48 2.62 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.1 mpp_? 52.92 45.92 27.81 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 5.0 t -111.81 -169.91 1.55 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.282 0.563 . . . . 0.0 109.933 -178.348 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.489 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -128.24 103.9 7.44 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 177.707 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 65' ' ' TRP . 10.1 mt -63.23 82.57 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.468 0 O-C-N 120.479 -1.388 . . . . 0.0 110.318 -176.394 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.2 pp -113.59 15.19 18.98 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HZ1' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -84.22 61.11 6.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.647 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.591 HG23 ' H ' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -75.12 -5.86 46.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.066 -1.021 . . . . 0.0 109.419 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.423 ' ND1' ' N ' ' A' ' 76' ' ' HIS . 6.4 m80 -68.79 -53.04 23.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.338 -0.852 . . . . 0.0 110.782 -179.068 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -97.24 -128.31 0.16 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -153.33 150.79 29.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.411 -1.431 . . . . 0.0 108.867 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.678 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -40.1 -49.32 2.58 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.504 -0.748 . . . . 0.0 111.224 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.452 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 23.0 t70 -46.91 -34.78 5.76 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.187 -0.945 . . . . 0.0 109.413 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.492 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -66.77 -30.44 70.65 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.534 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -79.31 -51.66 9.14 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.048 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.6 9.9 5.66 Favored Glycine 0 N--CA 1.51 3.598 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 53.2 mt -60.87 161.86 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 O-C-N 122.2 -0.588 . . . . 0.0 109.446 179.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -162.53 -159.02 0.54 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.255 -0.903 . . . . 0.0 109.279 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.68 -26.05 60.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.329 -0.857 . . . . 0.0 109.732 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -79.83 -1.81 40.64 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.111 -179.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.5 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.35 113.48 25.82 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.523 -0.736 . . . . 0.0 109.059 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -98.05 115.43 28.21 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.897 -1.127 . . . . 0.0 110.255 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.54 ' HG ' HD12 ' A' ' 20' ' ' LEU . 8.1 mt -91.54 176.29 6.6 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.496 ' O ' ' HA ' ' A' ' 63' ' ' LEU . 2.6 mt-30 -142.27 148.24 37.75 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.408 ' CZ ' ' O ' ' A' ' 61' ' ' HIS . 10.0 t80 -111.34 90.88 3.46 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.447 ' CB ' ' CD ' ' A' ' 94' ' ' PRO . 0.1 OUTLIER -107.57 -177.58 0.5 Allowed Pre-proline 0 N--CA 1.504 2.235 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.531 -178.134 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 93' ' ' THR . 37.2 Cg_exo . . . . . 0 N--CA 1.5 1.878 0 C-N-CA 122.639 2.226 . . . . 0.0 112.12 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 51.9 t80 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -82.32 -161.92 0.51 Allowed 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.232 -0.918 . . . . 0.0 109.725 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.439 ' CD ' ' HE ' ' B' ' 545' ' ' ARG . 0.4 OUTLIER -177.42 91.46 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 179.338 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -98.1 65.6 1.75 Allowed 'General case' 0 C--N 1.293 -1.863 0 O-C-N 121.869 -0.519 . . . . 0.0 110.689 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.439 ' HE ' ' CD ' ' B' ' 543' ' ' GLU . 18.5 mmt180 -64.3 -141.58 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.637 -1.289 . . . . 0.0 109.552 179.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . 159.06 -85.82 0.12 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m -166.18 119.51 1.1 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.27 136.71 58.12 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.887 -1.133 . . . . 0.0 110.527 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.553 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.1 OUTLIER -83.72 102.86 12.57 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 105.571 -2.011 . . . . 0.0 105.571 178.358 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.21 127.5 14.86 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.175 0.988 . . . . 0.0 110.654 -177.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.57 -26.2 25.47 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 106.788 -2.525 . . . . 0.0 106.788 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.4 t -110.51 -30.93 7.43 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 553' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' B' ' 549' ' ' CYS . 15.4 mm100 47.46 57.04 6.24 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-O 122.711 1.243 . . . . 0.0 112.02 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 37.3 mmtm -142.44 125.58 9.38 Favored Pre-proline 0 C--N 1.287 -2.135 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -44.03 136.41 7.62 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.415 1.184 . . . . 0.0 114.582 -178.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.553 HD11 ' HA ' ' B' ' 549' ' ' CYS . 43.8 mt -94.9 98.41 7.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 3.6 p -99.48 91.01 4.71 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.998 0.904 . . . . 0.0 111.179 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.06 -96.82 0.16 Allowed Glycine 0 N--CA 1.488 2.126 0 N-CA-C 107.675 -2.17 . . . . 0.0 107.675 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.12 153.31 28.42 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 20.7 p -144.09 126.5 15.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.014 -1.054 . . . . 0.0 111.558 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 51.6 mt -90.03 145.52 7.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.472 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 9.8 m -121.95 146.38 47.2 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-O 121.965 0.888 . . . . 0.0 109.193 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.742 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.34 -128.85 0.26 Allowed 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.8 mtt -65.44 25.63 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.593 -0.692 . . . . 0.0 109.255 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.742 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.07 -8.66 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 -178.082 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.57 148.94 28.87 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.124 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -95.13 174.19 7.19 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -159.95 132.05 6.3 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 118.56 -1.256 . . . . 0.0 109.81 -179.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.569 ' O ' ' N ' ' B' ' 571' ' ' GLU . 1.4 m80 -54.56 117.83 14.74 Favored Pre-proline 0 C--N 1.299 -1.593 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 176.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.436 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 32.1 Cg_exo -48.6 -9.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.303 -1.828 0 CA-C-N 120.48 1.207 . . . . 0.0 110.272 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.899 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.0 mt-10 -97.58 -52.85 3.63 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.62 0.724 . . . . 0.0 110.56 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -59.96 -2.72 0.44 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.612 -1.305 . . . . 0.0 109.685 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.445 ' H ' ' C ' ' B' ' 571' ' ' GLU . 5.8 t80 -128.06 56.6 1.59 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 178.064 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.899 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.0 m -95.1 177.82 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 CA-C-O 121.718 0.77 . . . . 0.0 111.5 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.619 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.87 145.86 30.15 Favored 'General case' 0 N--CA 1.505 2.303 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.72 76.33 3.22 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 116.915 -1.914 . . . . 0.0 109.949 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -152.57 -60.53 0.15 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 101.252 -3.61 . . . . 0.0 101.252 173.096 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 21.5 p -121.04 81.51 1.79 Allowed 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 111.659 -2.518 . . . . 0.0 104.803 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 0.461 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.9 mp -53.62 16.88 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -176.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.0 -36.9 19.49 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.585 -1.947 . . . . 0.0 112.522 -178.613 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.3 tp-100 -159.27 140.09 12.57 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 119.465 -2.022 . . . . 0.0 115.073 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.619 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.3 tp -139.99 170.48 15.78 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 175.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.5 m-20 -149.38 134.55 18.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.101 -1.0 . . . . 0.0 109.098 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.472 ' CE ' ' O ' ' B' ' 562' ' ' THR . 12.3 ptpt -51.91 -19.37 1.73 Allowed 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.456 -0.778 . . . . 0.0 109.634 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -18.26 55.73 Favored Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -134.05 25.41 3.91 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.557 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.3 109.01 20.12 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 122.5 1.143 . . . . 0.0 110.232 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -104.58 169.0 8.72 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.3 tt0 -152.38 157.23 40.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.678 -1.264 . . . . 0.0 110.781 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.432 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 2.8 tp60 -155.0 146.44 23.06 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 178.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.486 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.2 OUTLIER 45.56 23.65 0.15 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.997 -1.064 . . . . 0.0 109.909 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 82.49 -5.95 1.35 Allowed 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.816 -0.553 . . . . 0.0 110.768 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -90.27 118.91 69.18 Favored Pre-proline 0 C--N 1.295 -1.78 0 O-C-N 121.158 -0.964 . . . . 0.0 109.652 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.522 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 38.2 Cg_exo -49.27 164.98 0.25 Allowed 'Trans proline' 0 N--CA 1.491 1.335 0 CA-C-N 119.996 1.034 . . . . 0.0 112.288 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.522 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 22.5 m-85 -170.8 139.58 1.52 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.224 -0.923 . . . . 0.0 109.866 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.1 m -70.02 154.63 41.7 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -58.08 -55.53 33.79 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.98 -29.32 4.68 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.41 -58.47 3.11 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.613 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -60.27 -59.48 5.35 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.81 -0.556 . . . . 0.0 110.246 -179.764 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.71 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.55 -38.7 9.79 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.366 -0.834 . . . . 0.0 109.36 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.531 ' O ' HG21 ' A' ' 75' ' ' THR . 17.4 tptm -63.19 -20.71 65.66 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.542 -0.724 . . . . 0.0 110.855 -179.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.704 HD13 HD12 ' A' ' 46' ' ' LEU . 3.0 mt -92.11 -57.3 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.75 -1.219 . . . . 0.0 111.239 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.49 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 10.5 m-85 -96.07 12.03 32.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.16 -0.963 . . . . 0.0 109.905 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.49 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 26.4 m . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.25 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.5 mmt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 122.001 0.905 . . . . 0.0 108.948 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 5' ' ' GLY . . . 178.61 -8.33 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.804 -0.814 . . . . 0.0 108.804 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.435 ' C ' ' H ' ' A' ' 5' ' ' GLY . 1.7 mp -43.28 -65.71 0.46 Allowed 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.55 1.167 . . . . 0.0 109.87 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.427 ' C ' ' N ' ' A' ' 6' ' ' ILE . 19.1 t70 -76.91 12.71 1.26 Allowed 'General case' 0 C--N 1.287 -2.137 0 CA-C-N 114.891 -1.05 . . . . 0.0 108.545 -179.336 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -59.54 -13.79 25.12 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 107.432 -2.267 . . . . 0.0 107.432 179.269 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.668 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -114.61 -110.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 -179.66 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HB3' ' H ' ' A' ' 8' ' ' MET . 4.2 tpp180 -173.47 -87.97 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.235 0 O-C-N 120.86 -1.15 . . . . 0.0 111.159 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.412 ' H ' ' HB3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -117.96 -51.81 0.04 OUTLIER Pre-proline 0 N--CA 1.501 2.096 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -176.373 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -57.1 -37.8 97.33 Favored 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 121.624 1.55 . . . . 0.0 111.407 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.85 -20.59 5.37 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.12 0.88 88.96 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 108.719 -1.752 . . . . 0.0 108.719 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.562 ' O ' ' N ' ' A' ' 14' ' ' ALA . 38.4 t -153.13 -52.62 0.11 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.557 -0.966 . . . . 0.0 109.486 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.66 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 0.8 OUTLIER 61.93 -74.68 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -179.242 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 164.69 -37.78 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -156.63 7.52 0.19 Allowed 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.391 -0.818 . . . . 0.0 109.68 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.49 16.69 70.46 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.198 -1.961 . . . . 0.0 108.198 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.502 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 21.8 p -89.98 124.14 34.49 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.809 -0.818 . . . . 0.0 110.619 -178.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -119.0 122.15 41.52 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 177.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.626 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -79.37 128.78 33.76 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.106 -0.996 . . . . 0.0 109.975 -178.837 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.5 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.47 133.96 34.46 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.776 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.81 34.59 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -178.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.4 t -135.31 107.31 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 CA-C-O 121.802 0.81 . . . . 0.0 109.117 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.62 103.71 8.75 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.33 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -71.24 98.92 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 27' ' ' LEU . 19.7 p -68.19 -48.56 64.91 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.826 -0.546 . . . . 0.0 111.161 -177.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.91 12.22 0.23 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.753 -1.217 . . . . 0.0 109.698 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.498 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -141.36 -24.98 0.72 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 24' ' ' VAL . 27.5 t-20 77.15 13.25 2.08 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 122.041 -0.412 . . . . 0.0 110.234 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.5 mtp-105 -96.92 -178.16 4.13 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 120.966 -1.084 . . . . 0.0 109.687 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -137.51 114.23 10.47 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.435 HG12 ' N ' ' A' ' 32' ' ' THR . 30.3 t -110.65 157.65 11.35 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.401 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.593 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -131.72 135.3 46.73 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.495 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.594 HD22 ' N ' ' A' ' 33' ' ' LEU . 3.8 mm? -109.15 110.44 21.67 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.685 -0.634 . . . . 0.0 109.416 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.502 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.9 tpt180 -60.87 101.73 0.16 Allowed 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.7 m -133.55 -169.63 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-O 122.187 0.994 . . . . 0.0 110.742 -178.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.7 p -142.4 174.51 10.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.26 45.51 3.04 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.442 ' C ' HG21 ' A' ' 78' ' ' THR . 1.4 pp20? -146.61 4.87 0.9 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.595 -0.944 . . . . 0.0 108.948 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.596 ' O ' HG22 ' A' ' 78' ' ' THR . 2.5 m -89.83 138.28 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.122 -0.986 . . . . 0.0 110.335 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.487 ' O ' ' N ' ' A' ' 43' ' ' GLY . 2.6 m80 -82.0 146.12 29.88 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.025 -1.047 . . . . 0.0 108.585 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 73.7 mt -47.36 -56.5 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.953 -1.092 . . . . 0.0 109.896 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.02 -14.89 4.57 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.378 -1.889 . . . . 0.0 108.378 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.487 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.08 -27.49 58.06 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 108.511 -1.835 . . . . 0.0 108.511 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.405 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.18 -39.32 19.15 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.433 ' O ' HG23 ' A' ' 49' ' ' VAL . 38.6 mtm -51.39 -40.05 58.44 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -62.95 -58.41 7.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.623 -0.673 . . . . 0.0 109.931 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.492 ' HB2' HD12 ' A' ' 33' ' ' LEU . 54.7 mttm -54.95 -59.75 4.31 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.425 -0.797 . . . . 0.0 111.234 -178.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.7 tp -45.51 -38.26 6.13 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.958 -1.089 . . . . 0.0 109.716 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.714 HG22 ' CD2' ' A' ' 58' ' ' TRP . 54.0 t -70.24 -53.93 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -45.34 -47.25 13.32 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.188 0.518 . . . . 0.0 110.975 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.593 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 7.3 mtmp? -60.85 -58.06 10.06 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.229 -0.919 . . . . 0.0 110.634 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.6 tp -55.52 -49.99 71.15 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 t70 66.05 74.96 0.35 Allowed 'General case' 0 C--N 1.299 -1.617 0 CA-C-O 121.805 0.812 . . . . 0.0 109.989 178.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.428 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.31 144.68 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.999 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.979 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' CB ' ' B' ' 576' ' ' ALA . 20.6 mmtt -71.84 45.29 0.11 Allowed 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.535 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 40.8 tttm -76.26 171.18 14.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.415 -0.803 . . . . 0.0 110.429 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 8.4 m-20 -50.89 91.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.366 -0.833 . . . . 0.0 110.357 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.714 ' CD2' HG22 ' A' ' 49' ' ' VAL . 67.7 m95 -113.55 -13.51 12.76 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 122.282 1.039 . . . . 0.0 109.102 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.6 t -57.39 -54.11 50.47 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-O 121.778 0.799 . . . . 0.0 109.787 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.445 ' O ' ' O ' ' A' ' 94' ' ' PRO . 54.5 t0 -91.26 12.56 19.86 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.76 -0.588 . . . . 0.0 110.684 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.46 134.77 48.09 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.124 -0.985 . . . . 0.0 110.023 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.74 148.52 4.36 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.3 mm? -95.6 148.35 22.61 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.859 -1.151 . . . . 0.0 110.611 -178.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.528 ' HE1' ' CA ' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -129.94 137.65 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -99.7 91.67 4.97 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.528 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 16.5 pt-20 -57.51 -22.01 41.53 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.965 -1.084 . . . . 0.0 110.553 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.494 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -62.95 -13.38 34.05 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 177.762 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.444 ' N ' ' C ' ' A' ' 66' ' ' GLU . 18.9 mmtt -130.85 -12.8 3.71 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.477 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.4 mpp_? 54.11 45.9 26.52 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 -177.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.61 -175.42 2.67 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.647 0.737 . . . . 0.0 109.957 -178.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.467 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.67 102.35 7.3 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 177.655 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' A' ' 41' ' ' ILE . 28.8 mt -62.01 87.01 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.262 0 O-C-N 120.431 -1.418 . . . . 0.0 110.433 -176.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.7 pp -124.52 10.91 8.54 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 82.61 7.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.209 -0.932 . . . . 0.0 108.895 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.417 HG21 ' O ' ' B' ' 602' ' ' LYS . 0.2 OUTLIER -75.47 -12.06 60.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.095 -1.003 . . . . 0.0 109.984 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.521 ' O ' ' CG ' ' A' ' 77' ' ' TRP . 0.6 OUTLIER -90.78 44.07 1.18 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.866 -1.147 . . . . 0.0 109.468 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.521 ' CG ' ' O ' ' A' ' 76' ' ' HIS . 1.3 m0 -173.42 -169.87 0.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.059 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.698 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -139.97 -169.19 2.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.898 -1.126 . . . . 0.0 109.692 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.533 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.8 mp -65.25 -60.0 3.47 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -45.68 -52.83 10.24 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.857 0.837 . . . . 0.0 109.804 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.698 ' CG ' ' H ' ' A' ' 78' ' ' THR . 36.7 mmtt -45.43 -55.96 5.53 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.639 0.733 . . . . 0.0 109.731 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -41.73 69.63 Favored 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 119.827 -0.749 . . . . 0.0 109.155 -179.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.3 11.53 6.73 Favored Glycine 0 N--CA 1.5 2.908 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.475 HG22 ' N ' ' A' ' 85' ' ' GLN . 43.1 mt -71.23 160.71 5.08 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.606 -0.937 . . . . 0.0 109.513 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.475 ' N ' HG22 ' A' ' 84' ' ' ILE . 1.6 tp60 -170.76 -165.15 0.42 Allowed 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.94 -22.23 62.25 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.417 -0.802 . . . . 0.0 110.098 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -79.93 -10.0 59.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.157 -0.964 . . . . 0.0 108.844 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.468 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.93 112.83 25.09 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.9 115.59 27.97 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 109.964 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.5 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.4 mt -90.12 176.22 6.85 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.466 ' NE2' ' CZ2' ' A' ' 64' ' ' TRP . 1.2 mt-30 -140.63 148.93 41.64 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.1 OUTLIER -96.0 142.52 28.11 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.1 t -155.1 143.08 14.27 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' PRO . . . . . 0.445 ' O ' ' O ' ' A' ' 60' ' ' ASP . 90.3 Cg_endo . . . . . 0 N--CA 1.492 1.412 0 C-N-CA 122.036 1.824 . . . . 0.0 111.345 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 542' ' ' HIS . . . . . 0.471 ' C ' ' H ' ' B' ' 544' ' ' ARG . 31.5 m80 -67.66 -140.84 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.203 -0.935 . . . . 0.0 109.65 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 543' ' ' GLU . . . . . 0.427 ' C ' ' N ' ' B' ' 545' ' ' ARG . 10.1 pt-20 -59.5 -2.43 0.33 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.348 -0.845 . . . . 0.0 109.651 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.471 ' H ' ' C ' ' B' ' 542' ' ' HIS . 22.2 mmt180 -50.57 -13.51 0.14 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.234 -0.917 . . . . 0.0 109.577 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.427 ' N ' ' C ' ' B' ' 543' ' ' GLU . 21.6 mtp180 -66.93 -80.92 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.164 -0.96 . . . . 0.0 109.844 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -149.55 -109.36 0.49 Allowed Glycine 0 N--CA 1.496 2.657 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -166.58 118.61 0.99 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.322 -1.105 . . . . 0.0 108.047 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.3 mp -59.38 135.56 57.69 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.888 -1.133 . . . . 0.0 110.653 -178.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.499 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.89 103.97 13.59 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.267 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 18.3 t -51.65 127.21 19.83 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.201 1.001 . . . . 0.0 109.659 -177.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.74 -34.21 5.6 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.142 -2.783 . . . . 0.0 106.142 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.1 m -106.23 -36.2 6.95 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.72 56.37 6.21 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 122.639 1.209 . . . . 0.0 109.942 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.7 mmtm -140.53 124.06 10.32 Favored Pre-proline 0 N--CA 1.496 1.851 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -44.2 135.17 8.58 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 120.492 1.211 . . . . 0.0 114.855 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.54 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.8 mt -94.04 99.3 9.31 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 80.9 p -100.82 91.7 4.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.307 -0.871 . . . . 0.0 111.238 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.96 -96.59 0.16 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 107.334 -2.306 . . . . 0.0 107.334 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.489 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.3 mmt-85 -112.12 152.9 27.75 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.4 p -145.18 126.13 14.5 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.978 -1.076 . . . . 0.0 111.577 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.8 mt -90.54 146.07 6.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 178.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.468 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 8.9 m -120.0 146.54 45.76 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 121.916 0.865 . . . . 0.0 109.283 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.723 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.19 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.803 0 CA-C-O 121.605 0.717 . . . . 0.0 109.406 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.548 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.1 mtt -65.66 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.688 0 O-C-N 121.617 -0.677 . . . . 0.0 109.272 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.723 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.46 -9.05 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.17 159.99 24.49 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -103.84 174.68 5.77 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -160.09 133.58 6.98 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.268 -1.373 . . . . 0.0 110.005 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.568 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -54.16 114.3 6.35 Favored Pre-proline 0 C--N 1.302 -1.49 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.432 ' CG ' ' O ' ' B' ' 559' ' ' ARG . 36.8 Cg_exo -46.96 -9.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.422 0 CA-C-N 120.331 1.154 . . . . 0.0 111.535 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.877 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.9 mt-10 -98.69 -52.92 3.45 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.011 0.91 . . . . 0.0 110.008 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.514 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -56.91 -4.86 0.19 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.917 -1.114 . . . . 0.0 109.87 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 573' ' ' PHE . . . . . 0.466 ' H ' ' C ' ' B' ' 571' ' ' GLU . 30.1 t80 -125.47 53.7 1.53 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.877 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.9 m -93.1 178.26 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 122.17 0.986 . . . . 0.0 110.487 -178.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.627 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.42 150.93 28.14 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.21 -179.499 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 576' ' ' ALA . . . . . 0.568 ' CB ' ' NZ ' ' A' ' 55' ' ' LYS . . . -96.24 76.85 3.03 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 117.219 -1.792 . . . . 0.0 110.031 178.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 577' ' ' PHE . . . . . 0.48 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 27.9 t80 -152.65 -44.38 0.1 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 173.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.2 p -137.3 125.62 23.28 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 111.71 -2.495 . . . . 0.0 106.624 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.78 13.72 0.78 Allowed 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.055 -1.028 . . . . 0.0 111.84 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.449 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -91.93 -39.7 11.56 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-N 121.614 2.007 . . . . 0.0 115.204 -175.272 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.4 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.2 tp-100 -162.97 141.91 8.6 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 122.377 2.353 . . . . 0.0 116.09 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.627 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.9 tp -140.38 168.66 19.29 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 174.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 68.7 m-20 -147.67 134.98 20.62 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.066 -1.021 . . . . 0.0 109.163 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.468 ' CE ' ' O ' ' B' ' 562' ' ' THR . 11.3 ptpt -55.4 -14.13 1.77 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.73 0.776 . . . . 0.0 109.53 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -95.62 -14.97 45.04 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.6 p -136.41 26.79 3.14 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.94 -0.741 . . . . 0.0 109.083 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.575 ' HA ' HD11 ' B' ' 582' ' ' LEU . 2.8 p90 -88.25 109.39 19.9 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 122.32 1.057 . . . . 0.0 109.176 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.88 159.35 15.14 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.442 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.5 tt0 -155.24 157.25 37.0 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 122.699 1.237 . . . . 0.0 111.456 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.442 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 17.7 pt20 -160.9 146.19 14.33 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.547 ' N ' ' OD1' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.32 22.97 1.54 Allowed 'General case' 0 C--N 1.287 -2.129 0 O-C-N 121.263 -0.898 . . . . 0.0 109.155 -178.572 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.57 -7.07 1.47 Allowed 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.775 -0.578 . . . . 0.0 111.819 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -87.83 116.12 65.18 Favored Pre-proline 0 C--N 1.294 -1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 110.643 -178.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 34.6 Cg_exo -53.05 164.31 1.75 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 CA-C-N 119.883 0.994 . . . . 0.0 112.147 178.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.0 m-85 -171.04 139.91 1.46 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.287 -0.883 . . . . 0.0 110.229 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.53 155.14 40.96 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 103.529 -2.767 . . . . 0.0 103.529 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -59.15 -55.91 28.95 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.35 -26.97 0.92 Allowed 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.682 -0.636 . . . . 0.0 109.455 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 599' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 23.2 m -84.8 -60.23 2.12 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.479 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.6 OUTLIER -55.76 -54.66 41.68 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.684 . . . . 0.0 109.273 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.652 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.71 -41.79 32.99 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.628 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.417 ' O ' HG21 ' A' ' 75' ' ' THR . 0.4 OUTLIER -52.78 -26.95 15.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 109.016 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.3 mt -92.68 -57.25 2.73 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.195 -0.941 . . . . 0.0 111.25 -177.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' O ' ' B' ' 605' ' ' CYS . 11.6 m-85 -102.08 32.13 3.62 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.318 -0.864 . . . . 0.0 110.022 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.409 ' O ' ' O ' ' B' ' 604' ' ' PHE . 9.5 t . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 117.923 -1.037 . . . . 0.0 109.713 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ttt . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 3' ' ' LEU . . . -172.78 -34.09 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.294 -0.879 . . . . 0.0 109.639 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.482 ' O ' ' N ' ' A' ' 5' ' ' GLY . 74.9 mt -40.29 -81.07 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 122.058 0.933 . . . . 0.0 109.794 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 18.0 t70 42.65 23.86 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.803 0 CA-C-O 121.949 0.88 . . . . 0.0 109.33 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 3' ' ' LEU . . . -65.89 -12.83 58.22 Favored Glycine 0 N--CA 1.486 1.995 0 N-CA-C 108.448 -1.861 . . . . 0.0 108.448 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.682 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -111.37 -104.03 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.709 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -179.069 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.6 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -160.96 -102.62 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.168 0 O-C-N 120.588 -1.32 . . . . 0.0 109.985 -179.45 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.6 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -146.72 -64.01 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.17 -0.957 . . . . 0.0 110.288 -179.297 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.44 -34.21 14.1 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 CA-C-N 121.483 1.565 . . . . 0.0 109.789 178.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -106.66 -29.41 9.62 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.36 4.92 82.75 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.585 ' SG ' ' N ' ' A' ' 13' ' ' TYR . 2.1 t 178.19 -91.84 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.964 -0.727 . . . . 0.0 109.242 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.641 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 0.4 OUTLIER 167.75 -51.35 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 -179.485 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.641 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 161.39 -45.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -160.09 3.08 0.08 Allowed 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.726 -0.609 . . . . 0.0 109.774 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.492 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 78.49 36.83 28.98 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 p -85.67 122.86 30.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.611 -0.934 . . . . 0.0 110.427 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.492 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -137.81 122.52 18.69 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.788 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.617 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.74 130.11 36.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.225 -0.922 . . . . 0.0 108.717 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.491 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.6 133.7 34.83 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.2 145.5 35.53 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.242 -0.911 . . . . 0.0 109.62 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.5 t -138.16 106.25 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-O 121.9 0.857 . . . . 0.0 109.683 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -80.62 103.71 10.66 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.577 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.2 t -72.41 103.48 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.516 ' O ' ' N ' ' A' ' 27' ' ' LEU . 4.1 p -69.03 -65.55 0.69 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 110.89 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' N ' ' OG1' ' A' ' 25' ' ' THR . 25.7 t70 -49.35 -9.25 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.047 -1.033 . . . . 0.0 110.393 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 25' ' ' THR . 2.2 mt -120.86 -23.76 5.83 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.383 -0.823 . . . . 0.0 108.941 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 24' ' ' VAL . 28.2 t-20 74.27 13.92 3.82 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 122.143 -0.348 . . . . 0.0 110.406 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.425 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 56.6 mtp85 -97.25 -178.53 4.2 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.925 -1.11 . . . . 0.0 109.791 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 29' ' ' ARG . 83.7 m-20 -138.39 118.24 13.26 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 32' ' ' THR . 16.6 t -120.47 157.9 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.557 0.694 . . . . 0.0 109.629 -179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.445 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.11 136.63 45.94 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.445 HD22 ' C ' ' A' ' 32' ' ' THR . 3.2 mm? -114.46 113.04 23.94 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -60.28 101.97 0.15 Allowed 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 179.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.9 m -132.59 -174.9 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 CA-C-O 121.925 0.869 . . . . 0.0 110.316 -178.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 p -141.11 175.56 9.53 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.59 49.02 3.3 Favored Glycine 0 C--N 1.292 -1.882 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.406 ' HA ' HG21 ' A' ' 78' ' ' THR . 0.7 OUTLIER -145.72 -4.65 0.66 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.44 -1.036 . . . . 0.0 109.021 -179.952 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.531 ' O ' HG22 ' A' ' 78' ' ' THR . 1.2 m -87.5 150.29 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.162 -0.961 . . . . 0.0 110.455 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.3 138.72 31.31 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.517 HD13 ' HB3' ' A' ' 72' ' ' LEU . 38.7 mt -50.58 -49.03 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.953 -1.092 . . . . 0.0 108.499 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.509 ' H ' ' HB ' ' A' ' 75' ' ' THR . . . -53.49 -13.76 3.04 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 108.287 -1.925 . . . . 0.0 108.287 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.468 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -79.67 -38.56 20.08 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 108.155 -1.978 . . . . 0.0 108.155 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.61 -43.21 94.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.4 mtm -50.95 -32.78 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -77.94 -64.06 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.228 0.537 . . . . 0.0 109.939 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -51.63 -59.38 4.34 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.193 -0.942 . . . . 0.0 110.863 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.82 -55.25 5.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.151 -0.968 . . . . 0.0 108.78 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.412 HG13 ' CE2' ' A' ' 58' ' ' TRP . 14.2 t -56.81 -52.42 54.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 O-C-N 121.839 -0.538 . . . . 0.0 109.589 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -44.55 -40.51 5.75 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.204 -0.935 . . . . 0.0 110.159 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.471 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -71.66 -27.9 63.38 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.618 HD21 ' NZ ' ' A' ' 56' ' ' LYS . 7.2 tp -65.75 -58.63 5.21 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.186 -0.946 . . . . 0.0 109.031 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t0 69.17 72.06 0.26 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.765 0.793 . . . . 0.0 110.698 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.528 ' C ' ' H ' ' A' ' 56' ' ' LYS . 3.1 p -175.25 138.62 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.96 34.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.13 -0.981 . . . . 0.0 109.641 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.618 ' NZ ' HD21 ' A' ' 52' ' ' LEU . 6.6 ttpm? -78.03 168.81 19.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.041 -1.037 . . . . 0.0 109.469 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.457 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -50.17 109.36 0.29 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.455 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 44.3 m0 -103.83 -89.47 0.4 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 61' ' ' HIS . 4.9 t -43.6 -48.21 7.59 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.17 -0.956 . . . . 0.0 110.492 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' SER . 9.0 t0 -43.7 -19.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 1.6 p-80 -88.52 167.52 13.36 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 122.021 0.915 . . . . 0.0 109.821 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.54 153.12 4.97 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -94.07 147.16 23.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.973 -1.08 . . . . 0.0 109.288 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.525 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -133.27 137.02 45.86 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.719 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -96.46 91.28 5.73 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.477 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 13.3 pt-20 -57.16 -21.99 36.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.806 -1.184 . . . . 0.0 110.197 -178.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -62.16 -15.3 45.14 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 177.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.461 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -130.3 -12.56 4.01 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.755 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.516 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.2 mpp_? 54.42 45.96 26.0 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 -177.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.7 t -114.36 -173.29 2.26 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.443 0.639 . . . . 0.0 110.237 -178.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.425 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -123.95 102.95 8.04 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 177.557 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.517 ' HB3' HD13 ' A' ' 41' ' ' ILE . 25.1 mt -63.15 88.75 0.03 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.367 -1.458 . . . . 0.0 110.617 -176.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.539 ' H ' ' HE3' ' A' ' 74' ' ' LYS . 3.1 pp -120.78 10.1 10.86 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.539 ' HE3' ' H ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -72.22 38.62 0.07 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.134 -0.979 . . . . 0.0 110.846 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.509 ' HB ' ' H ' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -55.65 -6.84 0.22 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.287 -1.508 . . . . 0.0 108.704 179.477 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.498 ' H ' ' C ' ' A' ' 74' ' ' LYS . 16.1 t60 -59.86 -77.05 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 110.035 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -82.34 -118.7 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.098 -1.001 . . . . 0.0 109.647 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.531 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -153.75 150.56 28.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.642 -1.286 . . . . 0.0 109.757 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.66 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -43.86 -47.6 8.25 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.064 -1.022 . . . . 0.0 110.021 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.444 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 7.2 t70 -47.38 -34.17 6.72 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.312 -0.867 . . . . 0.0 109.518 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.1 -30.34 70.33 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -179.44 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 79' ' ' LEU . 1.1 t80 -81.37 -49.62 10.46 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 122.82 9.4 6.29 Favored Glycine 0 N--CA 1.512 3.754 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 47.0 mt -60.87 161.73 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 O-C-N 122.075 -0.662 . . . . 0.0 109.242 179.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -164.39 -168.28 1.49 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.91 . . . . 0.0 109.438 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.64 -26.55 67.12 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.294 -0.879 . . . . 0.0 109.896 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -76.79 -10.09 59.13 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.13 112.32 24.13 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.4 mmtp -97.54 117.29 31.49 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.944 -1.098 . . . . 0.0 109.837 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.487 ' HG ' HD12 ' A' ' 20' ' ' LEU . 5.2 mt -95.64 175.62 6.47 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.41 ' NE2' ' CH2' ' A' ' 64' ' ' TRP . 8.1 mt-30 -134.08 161.56 34.51 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 3.4 t80 -122.94 125.62 45.66 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.1 t -140.35 148.2 52.91 Favored Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.36 -0.837 . . . . 0.0 108.866 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo . . . . . 0 N--CA 1.496 1.668 0 C-N-CA 122.315 2.01 . . . . 0.0 111.936 -179.668 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 41.1 t80 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.266 0.555 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -154.8 -73.35 0.12 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.167 -0.958 . . . . 0.0 109.127 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -121.05 -7.97 9.37 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.625 -0.672 . . . . 0.0 109.391 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 544' ' ' ARG . . . . . 0.519 ' HG2' HH21 ' B' ' 544' ' ' ARG . 1.2 mmt-85 -50.55 -46.96 57.82 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.192 -0.942 . . . . 0.0 109.226 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 545' ' ' ARG . . . . . 0.434 ' O ' ' O ' ' B' ' 544' ' ' ARG . 11.9 mpt_? -57.06 -111.52 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.364 -0.835 . . . . 0.0 110.109 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -129.67 -83.5 0.33 Allowed Glycine 0 N--CA 1.502 3.041 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 547' ' ' SER . . . . . 0.556 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m -171.44 120.94 0.5 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.109 -1.23 . . . . 0.0 108.331 -178.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.4 mp -58.93 135.84 57.7 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.77 -1.206 . . . . 0.0 110.828 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 549' ' ' CYS . . . . . 0.503 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.14 104.13 13.93 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 178.073 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.2 t -51.77 127.06 19.68 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 122.137 0.97 . . . . 0.0 109.599 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.84 -33.24 6.15 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 106.199 -2.76 . . . . 0.0 106.199 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.4 m -107.65 -35.94 6.57 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 553' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 55.58 56.38 6.29 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 122.61 1.195 . . . . 0.0 110.038 -178.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -140.62 124.08 10.24 Favored Pre-proline 0 C--N 1.293 -1.863 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -44.05 136.02 7.84 Favored 'Trans proline' 0 N--CA 1.494 1.526 0 CA-C-N 120.441 1.193 . . . . 0.0 115.113 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 556' ' ' ILE . . . . . 0.556 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.7 mt -95.35 97.97 7.37 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 557' ' ' THR . . . . . 0.423 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.2 p -100.07 91.37 4.75 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.227 -0.92 . . . . 0.0 111.279 -177.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.3 -95.18 0.15 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 107.532 -2.227 . . . . 0.0 107.532 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 559' ' ' ARG . . . . . 0.482 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.0 mmt-85 -114.04 152.71 30.59 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.047 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 18.6 p -144.63 126.25 15.09 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.947 -1.096 . . . . 0.0 111.605 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -90.74 146.48 6.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 562' ' ' THR . . . . . 0.759 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.1 m -118.2 147.29 43.53 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 121.834 0.826 . . . . 0.0 109.226 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 563' ' ' ALA . . . . . 0.747 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.94 -129.08 0.25 Allowed 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.563 0.697 . . . . 0.0 109.495 -178.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 564' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.7 mtp -65.66 26.3 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 565' ' ' ALA . . . . . 0.747 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.95 -9.07 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.3 163.14 23.14 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 567' ' ' LYS . . . . . 0.508 ' O ' ' CD1' ' B' ' 568' ' ' PHE . 18.6 mmmt -104.8 174.56 5.83 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 568' ' ' PHE . . . . . 0.508 ' CD1' ' O ' ' B' ' 567' ' ' LYS . 2.9 m-85 -159.81 132.01 6.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.526 -1.359 . . . . 0.0 110.219 -178.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 569' ' ' HIS . . . . . 0.543 ' ND1' ' CE1' ' B' ' 572' ' ' HIS . 9.0 m80 -53.3 113.4 4.68 Favored Pre-proline 0 C--N 1.305 -1.347 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 176.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 570' ' ' PRO . . . . . 0.453 ' O ' ' OE1' ' B' ' 581' ' ' GLN . 31.2 Cg_exo -47.66 -13.26 0.17 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 CA-C-N 120.426 1.188 . . . . 0.0 110.802 -178.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 571' ' ' GLU . . . . . 0.867 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.9 mt-10 -92.22 -52.19 4.81 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 122.079 0.943 . . . . 0.0 110.359 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 572' ' ' HIS . . . . . 0.543 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -59.93 -5.67 1.06 Allowed 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.086 -1.009 . . . . 0.0 110.046 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 573' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -127.72 56.01 1.6 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 574' ' ' VAL . . . . . 0.867 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.2 m -94.85 177.27 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.765 0.793 . . . . 0.0 111.448 -178.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 575' ' ' CYS . . . . . 0.599 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.63 143.02 32.22 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 178.599 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.12 73.12 6.33 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 116.065 -2.254 . . . . 0.0 108.703 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 577' ' ' PHE . . . . . 0.416 ' O ' ' N ' ' A' ' 59' ' ' SER . 0.4 OUTLIER -157.52 -36.95 0.07 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 173.883 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 578' ' ' CYS . . . . . 0.584 ' O ' ' N ' ' B' ' 580' ' ' LYS . 29.8 p -137.12 82.43 1.93 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 178.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 579' ' ' LEU . . . . . 0.849 HD13 ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.46 13.96 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -176.493 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 580' ' ' LYS . . . . . 0.584 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -96.05 -38.3 10.26 Favored 'General case' 0 N--CA 1.505 2.323 0 CA-C-N 121.369 1.895 . . . . 0.0 113.024 -178.73 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 581' ' ' GLN . . . . . 0.453 ' OE1' ' O ' ' B' ' 570' ' ' PRO . 3.1 tp-100 -160.64 140.2 10.85 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 119.47 -2.019 . . . . 0.0 115.652 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 582' ' ' LEU . . . . . 0.599 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.2 tp -135.07 170.1 16.42 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.155 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 583' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' B' ' 587' ' ' PHE . 79.2 m-20 -144.8 129.23 17.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.051 -1.031 . . . . 0.0 109.261 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 584' ' ' LYS . . . . . 0.759 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 0.3 OUTLIER -53.85 -16.17 1.66 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.418 -0.801 . . . . 0.0 109.514 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.88 -17.76 53.07 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.8 p -135.63 28.94 3.26 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 587' ' ' PHE . . . . . 0.573 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 1.1 p90 -88.93 106.1 18.19 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 122.762 1.268 . . . . 0.0 109.738 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 588' ' ' LYS . . . . . 0.53 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.05 167.66 10.75 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 589' ' ' GLU . . . . . 0.445 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.7 tt0 -152.07 156.96 40.95 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 122.679 1.228 . . . . 0.0 110.593 -179.058 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 590' ' ' GLN . . . . . 0.498 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 1.8 tp60 -158.59 146.47 18.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 591' ' ' ASN . . . . . 0.476 ' O ' ' CB ' ' B' ' 592' ' ' ASP . 0.1 OUTLIER 47.1 22.37 0.22 Allowed 'General case' 0 C--N 1.296 -1.746 0 O-C-N 121.008 -1.057 . . . . 0.0 109.906 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 81.07 -3.96 1.72 Allowed 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.664 -0.648 . . . . 0.0 111.149 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -89.6 123.57 66.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 O-C-N 121.116 -0.99 . . . . 0.0 109.125 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 594' ' ' PRO . . . . . 0.494 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 45.8 Cg_exo -48.26 165.44 0.15 Allowed 'Trans proline' 0 N--CA 1.485 1.026 0 CA-C-N 120.301 1.143 . . . . 0.0 110.923 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 595' ' ' TYR . . . . . 0.53 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.1 m-85 -170.3 141.1 1.97 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.734 -1.229 . . . . 0.0 111.204 -178.384 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 26.4 m -78.63 154.2 30.44 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 104.627 -2.36 . . . . 0.0 104.627 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 597' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -61.44 -56.5 19.47 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 598' ' ' ASN . . . . . 0.59 ' HA ' HD22 ' B' ' 601' ' ' LEU . 1.4 m120 -44.97 -33.85 2.19 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.63 0.729 . . . . 0.0 109.741 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 68.0 m -78.66 -62.85 1.56 Allowed 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.419 -0.801 . . . . 0.0 110.015 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 600' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -57.78 -47.57 82.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 122.102 -0.374 . . . . 0.0 111.937 -178.17 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 601' ' ' LEU . . . . . 0.98 HD23 ' H ' ' B' ' 602' ' ' LYS . 0.0 OUTLIER -56.28 -51.4 68.31 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 120.721 -1.237 . . . . 0.0 108.438 -177.892 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 602' ' ' LYS . . . . . 0.98 ' H ' HD23 ' B' ' 601' ' ' LEU . 18.5 tttt -45.56 -24.93 0.38 Allowed 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.389 -0.82 . . . . 0.0 109.972 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 603' ' ' LEU . . . . . 0.452 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.3 OUTLIER -95.91 -57.03 2.47 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.078 -1.014 . . . . 0.0 111.161 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 604' ' ' PHE . . . . . 0.501 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 37.8 m-85 -97.92 22.42 9.29 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.153 -0.967 . . . . 0.0 110.336 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 605' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 58.2 m . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.343 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.575 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -96.16 125.66 40.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.273 -1.134 . . . . 0.0 109.999 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.502 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -128.97 120.97 27.03 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 178.18 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.619 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.86 127.74 33.91 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.963 -1.086 . . . . 0.0 109.02 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.477 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.95 134.59 34.65 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -77.98 145.4 36.04 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.487 -0.885 . . . . 0.0 108.981 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.84 104.06 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-O 121.829 0.823 . . . . 0.0 109.909 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -79.66 104.5 10.3 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.587 HG13 ' CD2' ' A' ' 92' ' ' PHE . 3.6 t -74.76 118.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.047 -1.461 . . . . 0.0 109.114 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.3 p -85.32 -25.96 26.85 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.411 -0.806 . . . . 0.0 109.39 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -78.04 -8.16 57.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 108.702 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mt -130.3 -22.64 2.77 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 75.47 12.56 3.16 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.331 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.427 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 74.9 mtp180 -95.32 -178.62 4.5 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.161 -0.962 . . . . 0.0 109.661 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 29' ' ' ARG . 72.4 m-20 -136.16 113.93 11.12 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 t -113.87 157.54 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-O 121.342 0.592 . . . . 0.0 109.489 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.446 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -128.51 135.99 50.18 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 32' ' ' THR . 3.1 mm? -115.34 113.55 23.95 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.777 -0.577 . . . . 0.0 109.743 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.575 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 9.0 tpt180 -60.25 105.6 0.43 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.9 m -134.18 -169.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.908 0.861 . . . . 0.0 110.591 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p -140.44 172.42 12.75 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.502 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -79.94 46.48 3.15 Favored Glycine 0 N--CA 1.485 1.903 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.442 ' C ' HG21 ' A' ' 78' ' ' THR . 4.9 pt-20 -149.75 4.31 0.57 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.675 -0.897 . . . . 0.0 108.928 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 78' ' ' THR . 3.1 m -87.02 137.29 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.945 -1.097 . . . . 0.0 109.959 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.463 ' O ' ' N ' ' A' ' 43' ' ' GLY . 4.2 m80 -79.73 147.83 31.76 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.042 -1.037 . . . . 0.0 108.656 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.442 ' C ' ' N ' ' A' ' 43' ' ' GLY . 59.5 mt -48.46 -52.56 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.126 -0.984 . . . . 0.0 109.381 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.64 -15.24 4.28 Favored Glycine 0 N--CA 1.484 1.857 0 N-CA-C 108.107 -1.997 . . . . 0.0 108.107 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -81.43 -28.32 44.4 Favored Glycine 0 N--CA 1.481 1.698 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.401 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.16 -55.29 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -1.126 . . . . 0.0 109.487 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -37.2 30.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.715 -1.24 . . . . 0.0 108.859 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.472 HD13 HD13 ' B' ' 603' ' ' LEU . 5.5 tp -57.52 -65.57 0.61 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.204 -0.935 . . . . 0.0 109.412 179.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -51.42 -59.46 4.21 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.409 -0.807 . . . . 0.0 111.523 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.919 HD23 ' HE2' ' A' ' 61' ' ' HIS . 25.1 tp -45.78 -46.07 15.08 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.091 -1.006 . . . . 0.0 109.83 -178.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.49 ' O ' ' N ' ' A' ' 52' ' ' LEU . 11.6 t -67.21 -48.38 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.032 -1.043 . . . . 0.0 108.826 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -45.04 -40.42 6.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.354 -0.841 . . . . 0.0 109.683 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -66.74 -31.9 72.86 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.349 -0.844 . . . . 0.0 108.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 49' ' ' VAL . 3.7 tp -67.7 -66.55 0.55 Allowed 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 t70 64.42 75.89 0.36 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.747 0.784 . . . . 0.0 110.051 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.545 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.5 p -173.07 152.55 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 C-N-CA 120.186 -0.605 . . . . 0.0 109.799 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -71.01 37.52 0.05 Allowed 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' ' 54' ' ' VAL . 19.2 tttp -77.97 179.97 6.44 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.082 -1.011 . . . . 0.0 109.237 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.521 ' N ' ' OD2' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -60.13 92.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.312 -0.867 . . . . 0.0 110.223 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.454 ' CE2' HG13 ' A' ' 49' ' ' VAL . 16.4 m0 -91.07 -35.98 14.29 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.253 -0.904 . . . . 0.0 109.511 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.559 ' C ' ' H ' ' A' ' 61' ' ' HIS . 3.7 t -73.99 -34.37 64.18 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.967 -1.083 . . . . 0.0 108.838 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -71.88 19.27 0.07 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.919 ' HE2' HD23 ' A' ' 48' ' ' LEU . 5.7 t-80 -105.65 130.43 53.68 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 122.024 0.916 . . . . 0.0 111.864 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 93' ' ' THR . . . -170.02 145.19 2.84 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.797 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.1 mm? -94.93 143.03 26.8 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.771 -1.206 . . . . 0.0 110.363 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.522 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.73 150.03 49.97 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.31 93.61 4.6 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.029 -1.044 . . . . 0.0 108.725 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -55.21 -23.73 23.73 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 111.058 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.528 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.2 mmtp -69.23 -8.89 49.99 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 178.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.6 mmtt -133.32 -12.43 2.77 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.731 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.39 46.21 27.09 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -178.148 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -112.43 -172.93 2.14 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.362 0.601 . . . . 0.0 109.868 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.557 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.04 98.66 5.2 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 177.424 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.402 ' HB3' HD13 ' A' ' 41' ' ' ILE . 29.0 mt -60.34 91.01 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 122.618 1.199 . . . . 0.0 109.984 -177.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 71' ' ' TRP . 1.9 pp -123.64 14.55 9.44 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.605 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -90.44 72.36 6.98 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.275 -0.891 . . . . 0.0 109.332 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.529 HG21 ' O ' ' B' ' 602' ' ' LYS . 3.1 m -62.38 -13.67 31.9 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.978 -1.076 . . . . 0.0 110.002 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.69 -50.91 15.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.102 -0.999 . . . . 0.0 109.767 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -172.14 1.65 Allowed 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.712 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -137.73 -164.92 1.69 Allowed 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.626 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.572 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.0 mp -69.72 -59.63 2.83 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -46.91 -51.99 15.53 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.137 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.712 ' CG ' ' H ' ' A' ' 78' ' ' THR . 33.8 mmtt -44.91 -55.01 5.84 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.542 0.687 . . . . 0.0 109.966 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.23 -40.22 59.25 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.136 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.88 7.01 8.91 Favored Glycine 0 N--CA 1.5 2.95 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.528 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 52.8 mt -62.0 160.86 2.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.45 -1.029 . . . . 0.0 109.386 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.92 -163.47 0.26 Allowed 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.1 62.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.88 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -75.12 -9.93 59.0 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.68 113.64 26.22 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -94.46 116.53 28.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.985 -1.072 . . . . 0.0 109.524 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.443 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.1 mt -94.81 176.79 6.13 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.444 0.64 . . . . 0.0 109.296 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.522 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.8 mt-30 -132.35 159.25 39.74 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -115.89 94.2 4.58 Favored 'General case' 0 N--CA 1.503 2.183 0 CA-C-O 122.484 1.135 . . . . 0.0 108.023 179.237 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.439 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.542 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.488 1.462 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.25 135.75 57.82 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 120.855 -1.153 . . . . 0.0 110.315 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.479 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.81 103.9 13.46 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.317 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.5 t -51.21 127.05 18.34 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 122.191 0.996 . . . . 0.0 109.59 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.67 -34.59 5.39 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 106.161 -2.776 . . . . 0.0 106.161 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.85 -35.57 7.29 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.457 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.5 mm-40 55.02 56.37 6.67 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.699 1.237 . . . . 0.0 109.957 -178.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -140.64 123.78 10.06 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -44.21 135.38 8.54 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 CA-C-N 120.489 1.21 . . . . 0.0 114.604 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.1 mt -93.4 98.34 8.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . 0.424 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.3 p -99.38 91.57 5.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.246 -0.909 . . . . 0.0 111.223 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.6 -95.26 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.481 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -114.76 152.33 32.26 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 177.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.6 126.53 15.4 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.932 -1.105 . . . . 0.0 111.541 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.9 mt -91.01 146.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 7.9 m -118.48 146.94 44.11 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-O 121.79 0.805 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.53 -129.39 0.26 Allowed 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.604 0.716 . . . . 0.0 109.331 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.554 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.3 mtt -65.78 26.34 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.01 -8.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.73 161.0 23.5 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.73 174.29 5.94 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -160.2 136.34 8.64 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.233 -1.387 . . . . 0.0 109.861 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.572 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.61 114.99 8.3 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.581 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.1 Cg_exo -45.69 -12.44 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 CA-C-N 120.316 1.148 . . . . 0.0 111.449 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.857 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.9 mt-10 -96.51 -52.73 3.84 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 122.001 0.905 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.517 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 19.1 m170 -57.61 -4.29 0.25 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.897 -1.127 . . . . 0.0 109.886 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.444 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.7 t80 -127.34 55.04 1.62 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.857 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.48 177.73 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.802 0.81 . . . . 0.0 111.116 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.638 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.19 143.42 29.63 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.408 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . 0.453 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -92.98 75.56 4.76 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 116.769 -1.972 . . . . 0.0 109.589 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -153.29 -54.51 0.11 Allowed 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 102.599 -3.112 . . . . 0.0 102.599 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.529 ' O ' ' N ' ' B' ' 580' ' ' LYS . 23.8 p -127.57 78.89 1.85 Allowed 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 111.567 -2.561 . . . . 0.0 104.253 177.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.5 mt -53.14 15.55 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.84 -37.13 18.03 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 119.735 -1.853 . . . . 0.0 112.122 -178.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.581 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.8 tp60 -159.65 140.89 12.69 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 119.636 -1.915 . . . . 0.0 114.466 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.638 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.0 tp -136.34 170.68 15.64 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.434 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.2 m-20 -144.94 128.47 17.03 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.277 -0.89 . . . . 0.0 109.143 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -15.99 0.8 Allowed 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.43 -0.794 . . . . 0.0 109.625 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.17 -21.05 50.98 Favored Glycine 0 N--CA 1.485 1.91 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -133.73 28.91 3.89 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.576 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.7 OUTLIER -89.94 108.98 20.04 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.489 1.137 . . . . 0.0 110.115 -179.692 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.5 160.0 14.81 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.8 tt0 -154.82 157.0 37.24 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 122.584 1.183 . . . . 0.0 111.115 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.452 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 2.9 pt20 -156.65 146.04 20.57 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 177.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.668 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.88 23.8 0.74 Allowed 'General case' 0 C--N 1.289 -2.048 0 O-C-N 121.29 -0.881 . . . . 0.0 109.465 -178.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.6 m-20 82.93 -7.06 1.23 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.791 -0.568 . . . . 0.0 111.661 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.7 mttm -86.01 116.22 64.87 Favored Pre-proline 0 C--N 1.293 -1.867 0 O-C-N 121.042 -1.036 . . . . 0.0 110.723 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.471 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.4 Cg_exo -52.57 162.84 2.09 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 CA-C-N 119.919 1.007 . . . . 0.0 112.328 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.471 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 20.1 m-85 -171.27 143.63 1.9 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.247 -0.908 . . . . 0.0 110.289 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.4 m -75.29 153.87 37.7 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 173.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.589 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -56.97 -57.13 13.87 Favored 'General case' 0 C--N 1.289 -2.036 0 C-N-CA 117.475 -1.69 . . . . 0.0 106.813 179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.27 -28.77 1.38 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.48 -0.763 . . . . 0.0 109.6 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 80.1 m -82.76 -61.08 1.97 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.312 -0.867 . . . . 0.0 109.039 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.45 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 1.1 t80 -55.45 -55.33 32.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.535 -0.728 . . . . 0.0 109.582 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.689 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.21 -42.83 31.16 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.209 -0.932 . . . . 0.0 109.14 -178.939 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.529 ' O ' HG21 ' A' ' 75' ' ' THR . 25.7 tptt -56.34 -23.85 40.01 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.215 -0.928 . . . . 0.0 110.002 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.472 HD13 HD13 ' A' ' 46' ' ' LEU . 4.6 mt -89.16 -56.9 3.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.921 -1.112 . . . . 0.0 111.303 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.496 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 16.7 m-85 -109.99 -25.72 10.11 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.262 -0.899 . . . . 0.0 110.59 -178.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.496 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.0 p . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.056 -1.028 . . . . 0.0 109.949 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.459 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 108.51 -1.836 . . . . 0.0 108.51 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.499 HG23 ' O ' ' A' ' 17' ' ' THR . 6.7 t -90.18 123.23 33.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.57 -0.959 . . . . 0.0 109.907 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.475 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -134.61 123.33 23.63 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.94 130.12 37.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.135 -0.978 . . . . 0.0 109.136 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.46 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.09 134.27 34.61 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.74 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -78.14 145.74 35.5 Favored 'General case' 0 C--N 1.297 -1.694 0 O-C-N 121.296 -0.877 . . . . 0.0 109.77 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 36.7 t -136.73 105.37 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.926 0.87 . . . . 0.0 109.767 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -78.72 104.86 9.62 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.549 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -71.95 100.61 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 O-C-N 121.336 -0.852 . . . . 0.0 110.077 -178.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.556 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -76.07 177.0 7.44 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 178.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.9 t70 56.8 6.57 0.31 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.727 -1.233 . . . . 0.0 107.918 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.556 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.8 mt -149.27 -37.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 77.25 15.97 1.72 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.521 178.402 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -91.17 -178.97 5.31 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.613 -1.304 . . . . 0.0 108.635 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -140.74 116.93 10.6 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.431 HG12 ' N ' ' A' ' 32' ' ' THR . 23.1 t -119.02 157.43 20.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-O 121.56 0.695 . . . . 0.0 109.792 -178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.501 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.43 134.6 43.81 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.626 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.501 HD22 ' C ' ' A' ' 32' ' ' THR . 3.8 mm? -114.3 114.13 25.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.6 -0.687 . . . . 0.0 109.398 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.471 ' HE ' ' HB3' ' A' ' 19' ' ' GLU . 1.3 tpp85 -57.84 108.52 0.59 Allowed 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.7 m -137.45 -169.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 122.062 0.934 . . . . 0.0 110.352 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -141.81 174.42 10.59 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.475 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -81.48 47.29 3.59 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.419 ' C ' HG21 ' A' ' 78' ' ' THR . 6.0 pt-20 -150.77 4.33 0.49 Allowed 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.737 -0.861 . . . . 0.0 108.994 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.508 ' O ' HG22 ' A' ' 78' ' ' THR . 2.5 m -86.01 143.35 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 120.914 -1.116 . . . . 0.0 109.846 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.503 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -78.56 146.36 34.3 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 179.446 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.465 ' C ' ' N ' ' A' ' 43' ' ' GLY . 97.3 mt -49.57 -56.33 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.053 -1.029 . . . . 0.0 108.828 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.626 ' H ' HG23 ' A' ' 75' ' ' THR . . . -56.45 -9.56 3.47 Favored Glycine 0 N--CA 1.485 1.912 0 N-CA-C 108.089 -2.004 . . . . 0.0 108.089 179.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.73 -28.0 66.01 Favored Glycine 0 N--CA 1.484 1.878 0 N-CA-C 107.611 -2.196 . . . . 0.0 107.611 178.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.38 -41.41 16.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 41.5 mtm -48.43 -36.67 15.35 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -71.57 -66.03 0.68 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.391 0.615 . . . . 0.0 110.096 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CB ' HD12 ' A' ' 33' ' ' LEU . 47.0 mttm -53.37 -55.78 22.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.306 -0.871 . . . . 0.0 110.666 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -45.83 -58.45 3.5 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.924 -1.11 . . . . 0.0 109.004 -179.254 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.513 ' O ' ' N ' ' A' ' 52' ' ' LEU . 73.2 t -57.29 -48.26 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.752 -0.592 . . . . 0.0 110.25 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -44.7 -40.04 5.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.081 -1.012 . . . . 0.0 109.512 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.508 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -70.7 -26.37 63.38 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.457 -0.777 . . . . 0.0 109.446 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.6 tp -80.04 -75.05 0.27 Allowed 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.338 -0.851 . . . . 0.0 108.801 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 t70 71.4 83.13 0.14 Allowed 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.835 0.826 . . . . 0.0 110.6 178.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.576 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -170.26 151.84 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.0 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.354 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.46 30.71 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 109.379 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.576 ' H ' ' C ' ' A' ' 54' ' ' VAL . 49.7 tttm -77.73 171.58 14.73 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.011 -1.055 . . . . 0.0 108.413 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.497 ' N ' ' OD1' ' A' ' 57' ' ' ASP . 0.6 OUTLIER -92.67 90.7 7.2 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 120.974 -1.079 . . . . 0.0 109.509 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.448 ' O ' ' O ' ' A' ' 61' ' ' HIS . 2.3 m0 -76.59 -51.56 11.4 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.177 -0.952 . . . . 0.0 108.529 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.8 p -41.51 -56.14 2.63 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.312 0.577 . . . . 0.0 110.406 -178.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -52.25 -40.5 61.78 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' O ' ' A' ' 58' ' ' TRP . 16.0 m170 -85.0 123.13 30.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.81 0.814 . . . . 0.0 110.324 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.16 -179.98 5.66 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.836 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.29 143.03 26.74 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.868 -1.145 . . . . 0.0 109.857 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.536 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -130.34 151.7 50.56 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.264 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -110.62 94.55 5.06 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.104 -0.998 . . . . 0.0 108.641 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.418 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 8.5 pt-20 -56.12 -23.55 35.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.245 -0.91 . . . . 0.0 110.813 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.536 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.7 mmtp -68.43 -9.64 49.94 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.1 mmtt -133.1 -12.17 2.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.915 -178.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.67 46.15 27.27 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -178.151 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -113.61 -173.5 2.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.612 0.72 . . . . 0.0 110.126 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.57 102.44 7.37 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.411 ' HB3' HD13 ' A' ' 41' ' ' ILE . 35.6 mt -61.9 86.57 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.325 0 O-C-N 120.504 -1.373 . . . . 0.0 110.548 -176.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.2 pp -120.99 10.88 10.89 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -87.07 36.33 0.73 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.626 HG23 ' H ' ' A' ' 42' ' ' GLY . 21.6 m -46.01 -14.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.223 -0.923 . . . . 0.0 110.058 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 8.4 m80 -62.63 -29.03 70.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.136 -0.977 . . . . 0.0 109.249 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 77.1 m95 -104.17 -155.26 0.53 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.438 -0.789 . . . . 0.0 109.406 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.672 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -144.44 171.29 14.56 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.165 0.983 . . . . 0.0 109.386 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.561 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 7.7 mp -48.11 -62.34 1.52 Allowed 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.127 0.965 . . . . 0.0 108.515 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -45.94 -52.01 12.33 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.874 0.845 . . . . 0.0 110.085 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.672 ' CG ' ' H ' ' A' ' 78' ' ' THR . 31.7 mmtt -45.13 -55.58 5.57 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 121.552 0.691 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.09 -41.86 63.61 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.979 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 121.65 7.08 8.3 Favored Glycine 0 N--CA 1.499 2.89 0 N-CA-C 108.844 -1.703 . . . . 0.0 108.844 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.532 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 50.5 mt -62.33 161.04 2.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.486 -1.008 . . . . 0.0 109.282 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.532 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.18 -164.63 0.36 Allowed 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.0 -24.29 62.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.403 -0.811 . . . . 0.0 109.694 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 88' ' ' ALA . 28.1 p30 -76.26 -11.46 59.92 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.267 -0.896 . . . . 0.0 108.67 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.456 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.55 113.52 25.97 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -94.46 117.14 29.67 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.106 -0.996 . . . . 0.0 109.773 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.46 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.5 mt -93.84 176.52 6.32 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.466 0.65 . . . . 0.0 109.25 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.536 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.6 mt-30 -133.34 167.73 19.88 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.441 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 25.0 t80 -124.01 99.0 6.04 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.154 0 O-C-N 121.356 -0.84 . . . . 0.0 111.037 -176.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.06 135.17 57.63 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 120.811 -1.181 . . . . 0.0 110.513 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.49 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.69 104.15 13.57 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.22 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.1 t -51.46 127.19 19.32 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.24 1.019 . . . . 0.0 109.674 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.7 -34.54 5.41 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 10.8 m -105.75 -35.97 7.2 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.463 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.7 mm-40 55.3 56.4 6.44 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.682 1.23 . . . . 0.0 109.997 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -140.79 124.08 10.07 Favored Pre-proline 0 C--N 1.294 -1.815 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -44.14 135.15 8.45 Favored 'Trans proline' 0 N--CA 1.491 1.376 0 CA-C-N 120.433 1.19 . . . . 0.0 114.842 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.0 mt -93.83 98.41 8.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.2 p -98.97 91.34 4.99 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.191 -0.943 . . . . 0.0 111.349 -177.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.0 -96.76 0.16 Allowed Glycine 0 N--CA 1.487 2.07 0 N-CA-C 107.579 -2.209 . . . . 0.0 107.579 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.486 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.2 mmt-85 -111.77 151.95 28.4 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 23.7 p -144.57 126.45 15.35 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.902 -1.124 . . . . 0.0 111.512 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 44.8 mt -90.75 146.06 6.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.466 ' H ' ' HD2' ' B' ' 584' ' ' LYS . 8.8 m -118.8 146.53 44.75 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.847 0.832 . . . . 0.0 109.009 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.739 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -129.29 0.26 Allowed 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.598 0.713 . . . . 0.0 109.287 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 3.1 mtt -66.29 26.69 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.739 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.27 -9.06 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.63 159.41 24.03 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . 0.404 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 16.9 mmmt -102.55 174.67 5.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 2.5 m-85 -160.29 132.85 6.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.236 -1.386 . . . . 0.0 110.225 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.537 ' ND1' ' ND1' ' B' ' 572' ' ' HIS . 9.6 m80 -53.88 113.81 5.51 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.597 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.88 -12.53 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.535 0 CA-C-N 120.458 1.199 . . . . 0.0 110.731 -178.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.877 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.5 mt-10 -91.86 -51.81 5.04 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 122.076 0.941 . . . . 0.0 110.243 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.537 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -61.48 -3.22 0.92 Allowed 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.168 -0.957 . . . . 0.0 109.896 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.409 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.1 t80 -132.19 59.21 1.72 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.877 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.9 m -94.59 177.76 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.931 0.872 . . . . 0.0 111.518 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.666 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.92 145.52 27.73 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.505 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.64 76.22 3.26 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 116.843 -1.943 . . . . 0.0 109.844 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -152.68 -52.48 0.11 Allowed 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 102.191 -3.263 . . . . 0.0 102.191 173.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.0 p -129.63 80.11 1.94 Allowed 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 111.437 -2.62 . . . . 0.0 104.47 176.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mt -52.43 16.11 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.836 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.52 -36.87 17.37 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 119.632 -1.917 . . . . 0.0 112.551 -178.673 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.05 140.14 12.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 119.611 -1.93 . . . . 0.0 114.653 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.666 HD13 ' HB2' ' B' ' 575' ' ' CYS . 22.2 tp -137.11 169.54 17.6 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.1 m-20 -147.09 131.24 17.35 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.313 -0.867 . . . . 0.0 109.229 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.466 ' HD2' ' H ' ' B' ' 562' ' ' THR . 14.6 ptmt -52.58 -21.89 4.37 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.443 -0.785 . . . . 0.0 109.476 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.64 -17.31 64.13 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -179.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.64 26.95 3.38 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.82 108.51 19.74 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 122.729 1.252 . . . . 0.0 110.06 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.531 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.99 167.88 9.55 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.424 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.5 tt0 -153.15 156.3 38.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.808 -1.183 . . . . 0.0 110.373 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.54 ' CD ' HD21 ' B' ' 591' ' ' ASN . 7.8 tt0 -157.96 146.68 19.21 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 178.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.666 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 50.08 21.99 0.84 Allowed 'General case' 0 C--N 1.29 -1.997 0 O-C-N 121.182 -0.949 . . . . 0.0 109.26 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.1 m-20 81.2 -4.99 1.66 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.786 -0.571 . . . . 0.0 110.716 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . 0.412 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 33.4 mttm -91.36 118.98 68.77 Favored Pre-proline 0 C--N 1.295 -1.795 0 O-C-N 121.258 -0.901 . . . . 0.0 109.575 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.0 Cg_exo -49.23 166.44 0.18 Allowed 'Trans proline' 0 N--CA 1.488 1.171 0 CA-C-N 120.135 1.084 . . . . 0.0 111.494 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' B' ' 588' ' ' LYS . 21.9 m-85 -170.55 137.3 1.36 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.08 -1.012 . . . . 0.0 110.756 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 16.3 m -69.55 154.28 42.23 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 173.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.594 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.81 -56.68 19.04 Favored 'General case' 0 C--N 1.289 -2.046 0 C-N-CA 117.479 -1.689 . . . . 0.0 106.459 179.516 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -45.53 -26.53 0.6 Allowed 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.587 -0.696 . . . . 0.0 109.845 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 93.4 m -84.48 -65.4 1.01 Allowed 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.155 -0.965 . . . . 0.0 109.31 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -51.27 -56.66 11.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.497 -0.752 . . . . 0.0 109.38 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.688 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.31 -42.47 31.12 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.262 -0.898 . . . . 0.0 109.064 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.405 ' O ' HG21 ' A' ' 75' ' ' THR . 24.1 tptp -58.8 -20.27 48.64 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.366 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.87 -56.44 3.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.751 -1.218 . . . . 0.0 110.779 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.41 ' O ' ' C ' ' B' ' 605' ' ' CYS . 9.5 m-85 -107.43 32.35 4.74 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.414 -0.804 . . . . 0.0 109.924 -178.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.41 ' C ' ' O ' ' B' ' 604' ' ' PHE . 9.4 t . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.924 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 108.804 -1.718 . . . . 0.0 108.804 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -95.7 122.53 38.56 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.471 -1.017 . . . . 0.0 109.802 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.609 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -131.27 120.93 23.89 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.26 129.37 35.81 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.162 -0.961 . . . . 0.0 109.215 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.474 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.79 134.42 34.73 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.183 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.22 146.24 35.05 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.272 -0.893 . . . . 0.0 109.794 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -138.51 105.44 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 CA-C-O 121.786 0.803 . . . . 0.0 110.059 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.494 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 2.8 m80 -79.59 104.75 10.41 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -71.11 98.21 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.258 -0.901 . . . . 0.0 109.915 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.502 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -70.03 164.28 24.34 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.9 t70 72.09 -43.65 0.57 Allowed 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 25' ' ' THR . 4.8 mt -93.25 -30.77 15.01 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.565 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 73.31 17.45 3.93 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.085 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtp85 -94.27 -178.73 4.7 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.899 -1.126 . . . . 0.0 109.142 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.494 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 9.9 m-20 -140.18 117.8 11.57 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG12 ' N ' ' A' ' 32' ' ' THR . 20.1 t -120.7 157.76 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.653 0.739 . . . . 0.0 110.013 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.463 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.06 135.36 45.3 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.463 HD22 ' C ' ' A' ' 32' ' ' THR . 3.7 mm? -113.53 111.59 22.15 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.511 -0.743 . . . . 0.0 109.322 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -61.11 102.45 0.21 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.9 m -129.95 -169.16 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 CA-C-O 121.936 0.874 . . . . 0.0 109.969 -178.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.7 p -139.32 169.59 17.49 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.609 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -77.13 44.66 2.17 Favored Glycine 0 N--CA 1.485 1.943 0 C-N-CA 119.386 -1.387 . . . . 0.0 109.634 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.486 ' C ' HG21 ' A' ' 78' ' ' THR . 3.9 pt-20 -146.61 4.04 0.87 Allowed 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.608 -0.936 . . . . 0.0 108.795 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -88.17 137.19 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.67 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.8 m80 -76.1 146.78 39.08 Favored 'General case' 0 C--N 1.293 -1.865 0 O-C-N 120.942 -1.099 . . . . 0.0 108.689 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.409 ' C ' ' N ' ' A' ' 43' ' ' GLY . 97.7 mt -45.93 -58.64 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.964 . . . . 0.0 109.583 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.506 ' H ' HG22 ' A' ' 75' ' ' THR . . . -54.8 -16.82 8.08 Favored Glycine 0 C--N 1.297 -1.602 0 N-CA-C 108.496 -1.841 . . . . 0.0 108.496 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -69.34 -29.17 71.94 Favored Glycine 0 N--CA 1.483 1.772 0 N-CA-C 107.941 -2.063 . . . . 0.0 107.941 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 t -84.79 -39.81 14.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.49 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.0 mtm -46.68 -37.67 8.68 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.764 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -78.22 -56.94 4.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.711 -0.618 . . . . 0.0 110.641 -178.514 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -53.03 -59.85 4.03 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.794 -1.191 . . . . 0.0 110.738 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.68 -44.92 13.84 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.153 -0.967 . . . . 0.0 109.364 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.423 HG13 ' CE2' ' A' ' 58' ' ' TRP . 39.9 t -68.27 -48.01 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.514 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -45.08 -39.24 5.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 0.0 109.866 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.54 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 8.7 mtmp? -75.93 -28.38 57.98 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.347 -0.846 . . . . 0.0 110.447 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.416 HD23 ' HE1' ' A' ' 58' ' ' TRP . 11.1 tp -60.99 -65.93 0.61 Allowed 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.084 -1.01 . . . . 0.0 108.878 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.2 t70 75.53 77.95 0.1 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.909 0.862 . . . . 0.0 110.422 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.557 ' O ' ' N ' ' A' ' 56' ' ' LYS . 3.0 p -175.05 126.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.007 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.477 ' HG3' HD12 ' B' ' 579' ' ' LEU . 18.1 tptt -65.0 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 109.873 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.557 ' N ' ' O ' ' A' ' 54' ' ' VAL . 4.5 ttpm? -77.66 161.23 27.94 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.041 -1.037 . . . . 0.0 108.701 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.418 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -66.71 93.37 0.25 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.296 -0.877 . . . . 0.0 109.38 -179.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.528 ' CZ2' ' O ' ' A' ' 54' ' ' VAL . 16.7 m0 -83.77 -46.49 12.17 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.839 0.828 . . . . 0.0 109.029 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.8 m -42.69 -55.19 3.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.299 -0.876 . . . . 0.0 110.47 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -50.5 -23.35 2.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.407 -0.808 . . . . 0.0 110.215 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.467 ' CB ' ' CZ ' ' A' ' 92' ' ' PHE . 21.9 m-70 -90.89 160.05 15.9 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.998 -1.064 . . . . 0.0 111.864 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.26 170.56 13.07 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.812 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -94.36 146.23 24.2 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.6 -1.313 . . . . 0.0 110.07 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.577 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -129.86 151.57 50.29 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.07 93.77 4.65 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.108 -0.995 . . . . 0.0 108.782 -179.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -55.48 -23.83 27.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.29 -0.881 . . . . 0.0 110.771 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.514 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.9 mmtp -67.51 -10.14 48.86 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 178.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -133.48 -12.04 2.74 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.984 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.5 mpp_? 52.28 46.18 27.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 -178.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -114.01 -171.15 1.85 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.607 0.717 . . . . 0.0 110.071 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.452 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -126.1 103.64 7.82 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 177.357 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.02 86.84 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.27 0 O-C-N 120.507 -1.371 . . . . 0.0 111.15 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.37 9.31 10.32 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.451 ' C ' ' H ' ' A' ' 76' ' ' HIS . 5.6 mmpt? -77.65 54.18 1.18 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.679 -0.638 . . . . 0.0 110.029 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.506 HG22 ' H ' ' A' ' 42' ' ' GLY . 6.1 p -59.13 -5.99 0.79 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.864 -1.147 . . . . 0.0 108.769 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.451 ' H ' ' C ' ' A' ' 74' ' ' LYS . 36.1 m80 -59.41 -40.78 87.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.519 -0.738 . . . . 0.0 110.971 -179.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -121.18 -162.46 0.97 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.608 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -120.24 -164.17 1.07 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.973 -1.079 . . . . 0.0 110.481 -178.257 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.631 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.1 mp -71.63 -59.26 2.85 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -47.01 -52.67 14.26 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.018 0.914 . . . . 0.0 109.72 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.608 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.4 mmtt -45.31 -55.06 6.33 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.674 0.75 . . . . 0.0 109.664 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -71.35 -43.62 66.61 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.256 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.37 4.21 8.38 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 108.819 -1.713 . . . . 0.0 108.819 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.52 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 38.4 mt -61.69 161.05 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 O-C-N 121.582 -0.952 . . . . 0.0 109.35 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -172.13 -161.96 0.19 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.361 -0.837 . . . . 0.0 109.143 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.83 -23.98 60.84 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.504 -0.748 . . . . 0.0 109.482 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -74.5 -11.92 60.35 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.474 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.46 113.15 25.34 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.9 mmtp -94.78 118.12 31.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.911 -1.118 . . . . 0.0 109.69 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HG ' HD12 ' A' ' 20' ' ' LEU . 11.0 mt -94.41 175.99 6.47 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.561 0.696 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.577 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -134.87 161.38 35.4 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 61.8 t80 -120.42 91.23 3.49 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.507 2.386 0 O-C-N 121.848 -0.533 . . . . 0.0 110.291 -177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.533 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m . . . . . 0 N--CA 1.487 1.395 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -58.13 134.4 56.43 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 120.942 -1.099 . . . . 0.0 110.713 -178.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.504 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.1 OUTLIER -82.8 104.0 12.71 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.866 -1.901 . . . . 0.0 105.866 178.206 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.0 t -48.7 124.75 8.86 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 122.034 0.921 . . . . 0.0 109.318 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 110.23 -37.21 3.86 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.8 m -101.86 -35.99 8.82 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.456 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 55.35 56.41 6.4 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.815 1.293 . . . . 0.0 109.427 -178.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -140.45 122.44 9.61 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.23 133.46 9.02 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 CA-C-N 120.539 1.228 . . . . 0.0 114.504 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.533 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -92.04 98.15 8.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.66 91.14 4.73 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.992 0.901 . . . . 0.0 111.238 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.07 -96.36 0.15 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 107.283 -2.327 . . . . 0.0 107.283 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.475 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.8 mmt-85 -112.39 149.86 31.92 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -145.04 126.64 15.11 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.911 -1.118 . . . . 0.0 111.521 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 43.0 mt -91.4 146.41 6.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.6 m -120.13 146.39 46.01 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.873 0.844 . . . . 0.0 108.945 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.716 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.74 -129.22 0.26 Allowed 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.551 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.88 25.94 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 109.245 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.716 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.99 -8.13 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -178.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 150.63 28.11 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . 0.414 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 18.2 mmmt -96.49 174.72 6.71 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . 0.414 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 0.9 OUTLIER -162.27 132.07 4.58 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 117.568 -1.653 . . . . 0.0 111.31 -178.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.592 ' O ' ' N ' ' B' ' 571' ' ' GLU . 2.6 m80 -50.59 112.27 2.76 Favored Pre-proline 0 C--N 1.297 -1.687 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 176.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.461 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 51.1 Cg_exo -44.62 -4.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.415 0 CA-C-N 120.186 1.102 . . . . 0.0 114.395 -178.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.967 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.8 mt-10 -112.16 -53.66 2.69 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 122.749 1.261 . . . . 0.0 108.814 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -46.78 -15.15 0.03 OUTLIER 'General case' 0 C--N 1.285 -2.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.453 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.519 ' N ' ' O ' ' B' ' 571' ' ' GLU . 55.1 t80 -118.53 54.08 0.96 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.967 HG13 ' O ' ' B' ' 571' ' ' GLU . 14.1 m -91.83 176.13 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.593 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -71.39 141.2 50.35 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . 0.49 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.87 74.88 6.48 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 116.377 -2.129 . . . . 0.0 108.486 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -150.85 -60.58 0.18 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 100.839 -3.763 . . . . 0.0 100.839 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.6 OUTLIER -104.8 155.28 19.04 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 176.156 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 1.066 ' H ' HD22 ' B' ' 579' ' ' LEU . 0.0 OUTLIER -105.55 14.21 28.88 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.033 -1.042 . . . . 0.0 111.265 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.573 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -102.86 -38.99 7.16 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.461 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.1 tp60 -162.42 142.0 9.46 Favored 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 122.447 2.385 . . . . 0.0 115.979 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.593 HD13 ' HB2' ' B' ' 575' ' ' CYS . 22.7 tp -137.41 168.4 19.72 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 174.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.8 m-20 -150.54 133.85 16.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.859 -1.15 . . . . 0.0 109.843 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -50.39 -18.85 0.7 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.563 0.697 . . . . 0.0 109.697 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.76 -21.26 51.33 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . 0.449 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.5 p -134.62 26.79 3.71 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.58 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.65 108.37 19.77 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 122.589 1.185 . . . . 0.0 110.256 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.49 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.73 169.85 8.37 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.063 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.422 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.7 tt0 -151.34 157.19 42.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.653 -1.279 . . . . 0.0 110.832 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.621 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.7 OUTLIER -153.22 146.07 24.42 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.527 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.03 23.54 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.057 -1.027 . . . . 0.0 110.064 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.487 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.2 m-20 82.66 -4.82 1.35 Allowed 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.811 -0.556 . . . . 0.0 110.702 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 39.1 mttm -91.57 124.54 60.54 Favored Pre-proline 0 C--N 1.295 -1.787 0 O-C-N 121.302 -0.874 . . . . 0.0 109.698 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.492 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.8 Cg_exo -49.09 163.64 0.32 Allowed 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 119.971 1.025 . . . . 0.0 112.479 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.499 ' OH ' HD21 ' A' ' 46' ' ' LEU . 13.5 m-85 -170.73 141.69 1.86 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.335 -0.853 . . . . 0.0 109.796 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . 0.468 ' SG ' ' CB ' ' B' ' 575' ' ' CYS . 6.0 m -74.49 157.05 36.23 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.57 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.83 -57.31 13.21 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 179.1 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.56 -30.18 2.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.454 -0.778 . . . . 0.0 108.936 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 8.6 m -79.43 -62.56 1.65 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.545 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.3 OUTLIER -56.73 -55.96 27.51 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-O 121.15 0.5 . . . . 0.0 110.585 -179.685 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.637 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -47.66 -42.16 23.96 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.228 -0.92 . . . . 0.0 109.091 -178.566 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.472 ' O ' HG21 ' A' ' 75' ' ' THR . 28.3 tttt -59.67 -20.9 59.27 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.187 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.764 HD13 HD12 ' A' ' 46' ' ' LEU . 6.6 mt -90.6 -56.74 3.08 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.131 -0.98 . . . . 0.0 111.509 -178.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.621 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.2 m-85 -89.37 30.64 0.97 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.874 -1.141 . . . . 0.0 110.396 -178.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.503 ' SG ' ' O ' ' B' ' 601' ' ' LEU . 3.2 m . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.912 -1.117 . . . . 0.0 109.291 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.486 2.028 0 N-CA-C 108.168 -1.973 . . . . 0.0 108.168 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.675 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 12.4 p -79.45 129.62 34.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.481 -1.011 . . . . 0.0 109.648 -179.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.548 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -153.04 137.67 16.88 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.589 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -90.38 132.3 35.68 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.014 -1.053 . . . . 0.0 110.1 -179.575 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.524 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.42 134.2 34.48 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.27 145.73 35.25 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.169 -0.957 . . . . 0.0 108.69 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.2 t -138.51 106.7 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-O 121.78 0.8 . . . . 0.0 110.193 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.521 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 16.4 m170 -82.11 103.97 12.11 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.543 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -73.97 108.61 5.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 118.654 -1.219 . . . . 0.0 108.22 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.89 -23.46 38.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 109.057 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -78.84 -8.33 58.71 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.1 mt -130.15 -21.06 2.99 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.543 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.98 12.55 2.26 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 122.033 -0.417 . . . . 0.0 110.143 -179.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 16.5 mtp-105 -98.3 -178.12 3.93 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 121.03 -1.044 . . . . 0.0 109.856 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.521 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 20.3 m-20 -135.97 116.68 13.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 32' ' ' THR . 29.6 t -115.93 158.04 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-O 121.626 0.727 . . . . 0.0 109.772 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.453 ' N ' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -132.72 131.05 40.81 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.912 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.43 HD22 ' O ' ' A' ' 32' ' ' THR . 2.7 mm? -115.45 118.11 32.26 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.675 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -60.41 139.59 57.61 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 178.459 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.599 ' HB ' HG11 ' A' ' 39' ' ' VAL . 5.5 m -160.26 -175.16 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.443 0 CA-C-O 121.882 0.849 . . . . 0.0 109.741 -177.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.519 ' O ' HG12 ' A' ' 39' ' ' VAL . 15.1 p -140.49 173.05 11.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.97 49.74 4.02 Favored Glycine 0 C--N 1.29 -2.009 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -153.5 1.69 0.26 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.76 -0.847 . . . . 0.0 109.356 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.599 HG11 ' HB ' ' A' ' 35' ' ' VAL . 0.2 OUTLIER -85.8 151.41 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.717 -1.239 . . . . 0.0 108.303 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.64 ' CD2' ' H ' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -87.67 142.75 27.59 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 121.235 -0.916 . . . . 0.0 109.17 179.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.65 HD13 ' HB3' ' A' ' 72' ' ' LEU . 38.6 mt -47.16 -57.81 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-O 122.179 0.99 . . . . 0.0 109.222 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.413 ' H ' HG23 ' A' ' 75' ' ' THR . . . -53.69 -14.36 3.71 Favored Glycine 0 C--N 1.295 -1.733 0 N-CA-C 108.512 -1.835 . . . . 0.0 108.512 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.79 -25.48 62.48 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -79.58 -55.09 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.413 -1.051 . . . . 0.0 109.757 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -21.95 4.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.449 -1.407 . . . . 0.0 108.585 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.504 ' C ' HD23 ' A' ' 46' ' ' LEU . 3.2 tt -71.69 -58.32 3.59 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -61.76 -51.87 66.56 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.306 -0.871 . . . . 0.0 110.625 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.432 HD21 ' CD1' ' A' ' 92' ' ' PHE . 57.3 tp -44.82 -54.24 6.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.089 -1.007 . . . . 0.0 110.604 -178.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.88 -44.06 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 120.722 -1.236 . . . . 0.0 110.098 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -45.01 -38.45 4.81 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.125 -0.985 . . . . 0.0 109.986 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.532 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.3 mtmp? -67.91 -48.5 65.81 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.381 -0.824 . . . . 0.0 110.421 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.8 OUTLIER -65.0 -68.11 0.39 Allowed 'General case' 0 C--N 1.307 -1.262 0 O-C-N 120.877 -1.139 . . . . 0.0 108.33 179.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 10.2 t0 80.36 88.23 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.119 0.962 . . . . 0.0 110.377 178.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.488 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -169.78 140.12 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.285 -2.223 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.276 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -67.32 35.54 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.639 -0.663 . . . . 0.0 110.567 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.488 ' H ' ' C ' ' A' ' 54' ' ' VAL . 13.6 ttmm -78.81 144.9 34.64 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 118.385 -1.326 . . . . 0.0 108.85 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.526 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 4.4 m-20 -54.73 96.11 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.628 -0.67 . . . . 0.0 110.073 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.47 ' O ' ' N ' ' A' ' 61' ' ' HIS . 47.6 m95 -107.21 -29.64 9.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.329 -0.857 . . . . 0.0 109.612 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 p -44.33 -42.89 7.11 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.617 -0.677 . . . . 0.0 110.149 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 15.7 t0 -75.1 -15.87 60.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.385 -0.822 . . . . 0.0 109.621 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.526 ' CE1' ' O ' ' A' ' 57' ' ' ASP . 2.4 m80 -85.18 128.36 34.64 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.209 -0.932 . . . . 0.0 110.789 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -139.3 176.82 8.38 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.775 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.7 mm? -94.75 145.12 25.09 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.818 -1.176 . . . . 0.0 110.304 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.516 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.21 151.53 49.15 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.539 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.84 94.7 5.08 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.078 -1.014 . . . . 0.0 108.97 -179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.415 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 10.4 pt-20 -56.04 -23.69 34.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.23 -0.919 . . . . 0.0 110.762 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.523 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.9 mmtp -68.39 -9.57 49.21 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 178.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.27 -12.14 2.8 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.983 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.539 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.65 46.65 26.32 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.8 t -115.06 -170.73 1.81 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.313 0.578 . . . . 0.0 109.774 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.532 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.55 97.42 4.54 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.525 -1.657 . . . . 0.0 106.525 177.212 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 41' ' ' ILE . 11.1 mt -60.85 85.32 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.901 -1.124 . . . . 0.0 110.05 -176.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -119.97 10.27 11.46 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.461 ' HD3' HD12 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -91.54 68.52 5.7 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.427 -0.796 . . . . 0.0 109.398 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.417 ' O ' ' O ' ' B' ' 605' ' ' CYS . 3.7 m -60.24 -5.51 1.13 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.995 -1.065 . . . . 0.0 108.968 179.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.44 ' H ' ' C ' ' A' ' 74' ' ' LYS . 40.1 m80 -59.27 -61.75 2.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.836 . . . . 0.0 112.099 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.461 ' CH2' HD11 ' A' ' 41' ' ' ILE . 11.7 p-90 -88.07 -159.01 0.5 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.689 -1.257 . . . . 0.0 110.852 -178.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.664 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -139.23 165.27 27.62 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.92 -1.113 . . . . 0.0 110.24 -178.208 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.471 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 11.1 mp -38.95 -65.4 0.37 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.076 0.941 . . . . 0.0 109.721 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -44.49 -52.29 8.04 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.852 0.834 . . . . 0.0 110.259 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.664 ' CG ' ' H ' ' A' ' 78' ' ' THR . 40.9 mmtt -45.25 -54.65 6.76 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.46 0.648 . . . . 0.0 109.722 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.86 -43.85 57.34 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.098 -1.041 . . . . 0.0 108.908 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 119.13 11.64 7.4 Favored Glycine 0 N--CA 1.5 2.913 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.55 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 33.7 mt -61.21 161.19 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.574 -0.957 . . . . 0.0 108.866 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -161.99 -169.15 2.11 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.297 -0.877 . . . . 0.0 109.239 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.537 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -69.91 -19.97 63.38 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.614 -0.679 . . . . 0.0 109.562 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.3 p30 -80.47 -8.26 59.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.289 -0.882 . . . . 0.0 109.184 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.524 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -93.07 113.35 25.59 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -93.28 115.88 28.46 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.767 -1.208 . . . . 0.0 109.551 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.406 ' HG ' HD12 ' A' ' 20' ' ' LEU . 9.9 mt -97.55 176.99 5.65 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.698 0.761 . . . . 0.0 109.507 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.516 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -132.81 168.59 18.11 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.194 -1.409 . . . . 0.0 107.194 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.432 ' CD1' HD21 ' A' ' 48' ' ' LEU . 20.2 t80 -133.31 99.35 4.5 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.23 0 C-N-CA 120.214 -0.595 . . . . 0.0 111.642 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m . . . . . 0 N--CA 1.488 1.447 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -59.03 135.04 57.5 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.783 -1.198 . . . . 0.0 110.211 -178.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.52 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.62 103.73 13.17 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.6 t -48.82 125.1 9.6 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-O 122.035 0.921 . . . . 0.0 109.639 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.5 -34.62 5.38 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 106.479 -2.648 . . . . 0.0 106.479 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.3 m -105.31 -35.26 7.6 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.452 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.3 mm-40 54.55 56.42 6.84 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.824 1.297 . . . . 0.0 109.881 -178.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -140.71 123.62 9.92 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -44.24 134.09 8.94 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 CA-C-N 120.574 1.241 . . . . 0.0 114.433 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.3 mt -91.74 98.31 8.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . 0.429 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.5 p -99.46 91.01 4.72 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.286 -0.884 . . . . 0.0 111.159 -177.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.74 -96.2 0.15 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.462 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.6 mmt-85 -113.88 150.58 33.44 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 177.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 26.5 p -144.46 126.66 15.67 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.951 -1.093 . . . . 0.0 111.76 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 40.9 mt -91.32 146.68 5.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.438 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 12.2 m -120.72 146.53 46.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 121.81 0.814 . . . . 0.0 108.897 179.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.724 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.7 -129.02 0.26 Allowed 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.5 mtp -65.79 25.89 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.559 -0.713 . . . . 0.0 109.147 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.724 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.11 -8.51 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 -178.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.25 148.7 28.24 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -95.94 174.65 6.83 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.49 137.57 8.04 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.142 -1.423 . . . . 0.0 110.121 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.612 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.0 m80 -57.9 117.05 16.65 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.514 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.4 Cg_exo -44.11 -8.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.302 0 CA-C-N 120.114 1.076 . . . . 0.0 112.758 -178.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.717 ' O ' HG13 ' B' ' 574' ' ' VAL . 8.2 mt-10 -106.41 -53.16 2.67 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 122.149 0.976 . . . . 0.0 109.623 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.47 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 15.4 m170 -55.5 -5.0 0.11 Allowed 'General case' 0 C--N 1.292 -1.927 0 O-C-N 120.312 -1.493 . . . . 0.0 109.495 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.492 ' H ' ' C ' ' B' ' 571' ' ' GLU . 39.8 t80 -125.44 52.96 1.58 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.717 HG13 ' O ' ' B' ' 571' ' ' GLU . 11.6 m -92.93 177.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.639 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -80.39 141.85 34.95 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.53 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.4 75.6 3.89 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 116.842 -1.943 . . . . 0.0 109.915 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . 0.407 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 69.1 t80 -153.33 -54.12 0.11 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 102.459 -3.163 . . . . 0.0 102.459 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.521 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.7 p -126.75 77.75 1.74 Allowed 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 111.68 -2.509 . . . . 0.0 104.396 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 0.703 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.3 mp -53.04 16.85 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.521 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.1 -37.71 21.67 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 119.545 -1.972 . . . . 0.0 112.233 -178.718 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -161.54 143.89 11.92 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 119.54 -1.975 . . . . 0.0 113.843 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.639 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.5 tp -136.62 170.59 15.82 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' B' ' 587' ' ' PHE . 70.3 m-20 -149.61 131.79 15.44 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.182 -0.949 . . . . 0.0 109.455 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.438 ' HE3' ' H ' ' B' ' 562' ' ' THR . 14.7 ptpt -51.11 -19.16 1.03 Allowed 'General case' 0 C--N 1.302 -1.494 0 CA-C-O 121.564 0.697 . . . . 0.0 109.813 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.0 -20.54 55.28 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -134.34 26.62 3.8 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.52 107.73 19.35 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 122.657 1.218 . . . . 0.0 110.389 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.97 166.25 10.56 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.428 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.1 tt0 -153.01 157.28 40.3 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.815 -1.178 . . . . 0.0 110.653 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.503 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.6 tp-100 -156.22 146.13 21.2 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.573 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 46.41 23.65 0.24 Allowed 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.041 -1.037 . . . . 0.0 109.643 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 81.55 -5.74 1.55 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.782 -0.574 . . . . 0.0 110.8 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -88.34 116.25 65.67 Favored Pre-proline 0 C--N 1.294 -1.806 0 O-C-N 121.206 -0.934 . . . . 0.0 109.54 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.515 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 42.6 Cg_exo -49.51 164.2 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 CA-C-N 119.908 1.003 . . . . 0.0 112.141 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.515 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.77 140.03 1.6 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.179 -0.951 . . . . 0.0 110.163 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . 0.4 ' HG ' ' CB ' ' B' ' 575' ' ' CYS . 11.0 m -73.51 152.88 40.53 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 174.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.546 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -55.69 -57.46 11.9 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -45.35 -29.44 1.05 Allowed 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.58 -0.7 . . . . 0.0 109.316 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 76.2 m -84.62 -66.17 0.92 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.611 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -43.86 -56.5 3.84 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.656 0.741 . . . . 0.0 109.577 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.643 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.73 -43.31 62.83 Favored 'General case' 0 C--N 1.293 -1.854 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -178.802 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -64.69 -20.48 66.34 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.705 -1.247 . . . . 0.0 110.807 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -90.17 -56.46 3.21 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.3 -1.5 . . . . 0.0 112.067 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.29 30.73 4.37 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.223 -0.923 . . . . 0.0 112.381 -176.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.417 ' O ' ' O ' ' A' ' 75' ' ' THR . 2.4 t . . . . . 0 N--CA 1.5 2.058 0 O-C-N 120.604 -1.31 . . . . 0.0 108.805 178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.531 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.494 2.529 0 N-CA-C 108.443 -1.863 . . . . 0.0 108.443 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.92 122.4 23.37 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.568 -0.96 . . . . 0.0 109.532 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.531 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -133.01 124.55 27.9 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.616 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.12 128.71 34.21 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.819 -1.176 . . . . 0.0 109.134 -179.798 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.516 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.01 133.35 34.68 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.573 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.55 145.5 34.8 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.396 -0.815 . . . . 0.0 110.019 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.8 t -135.2 100.42 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.762 0.792 . . . . 0.0 109.066 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.534 ' CE1' ' OD1' ' A' ' 30' ' ' ASP . 7.7 m-70 -77.94 104.06 8.26 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.549 HG13 ' CD1' ' A' ' 92' ' ' PHE . 4.8 t -74.75 117.88 19.62 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.128 -1.429 . . . . 0.0 108.965 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.423 ' H ' HG23 ' A' ' 25' ' ' THR . 0.6 OUTLIER -85.27 -23.6 28.11 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.371 -0.831 . . . . 0.0 109.72 -179.333 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.481 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -79.92 -8.86 59.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.0 108.373 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.404 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.0 mt -129.0 -23.62 3.02 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.523 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.22 12.11 2.78 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 -179.42 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -94.92 -177.96 4.34 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.197 -0.939 . . . . 0.0 109.445 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.534 ' OD1' ' CE1' ' A' ' 23' ' ' HIS . 2.1 m-20 -136.7 113.19 10.06 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.401 HG12 ' N ' ' A' ' 32' ' ' THR . 21.4 t -107.76 157.48 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.494 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.2 139.79 47.19 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 2.3 mm? -120.16 112.55 19.23 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.663 -0.648 . . . . 0.0 109.56 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -61.47 107.01 0.72 Allowed 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -135.33 -168.94 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 CA-C-O 121.842 0.83 . . . . 0.0 110.339 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.6 p -141.84 173.35 11.59 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.17 44.52 2.65 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.431 ' C ' HG21 ' A' ' 78' ' ' THR . 0.2 OUTLIER -144.67 2.95 1.09 Allowed 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.615 -0.932 . . . . 0.0 108.843 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.575 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -89.08 135.21 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 O-C-N 121.146 -0.971 . . . . 0.0 110.259 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.488 ' O ' ' N ' ' A' ' 43' ' ' GLY . 9.4 m-70 -78.4 148.2 33.75 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.921 -1.112 . . . . 0.0 108.866 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.529 HD12 ' O ' ' A' ' 74' ' ' LYS . 38.7 mt -47.36 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.131 -0.981 . . . . 0.0 109.251 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.56 -13.36 2.87 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 108.625 -1.79 . . . . 0.0 108.625 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -82.23 -26.94 46.28 Favored Glycine 0 N--CA 1.483 1.833 0 N-CA-C 109.261 -1.536 . . . . 0.0 109.261 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.7 t -80.79 -55.26 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -1.105 . . . . 0.0 109.543 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.463 ' SD ' HD22 ' B' ' 603' ' ' LEU . 0.0 OUTLIER -49.56 -40.58 38.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.766 -1.209 . . . . 0.0 108.996 179.771 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.8 tt -54.47 -58.88 5.73 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.079 -1.013 . . . . 0.0 109.35 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -59.39 -57.84 11.22 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.246 -0.909 . . . . 0.0 110.919 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.5 tp -44.81 -41.73 7.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.366 -0.834 . . . . 0.0 110.182 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.634 HG22 ' CD2' ' A' ' 58' ' ' TRP . 93.2 t -74.67 -43.49 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.821 -1.174 . . . . 0.0 109.52 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -45.79 -38.87 7.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.257 -0.902 . . . . 0.0 108.933 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.533 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 54.5 mttp -67.44 -57.38 6.66 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.479 -0.763 . . . . 0.0 109.294 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.536 ' C ' ' H ' ' A' ' 54' ' ' VAL . 3.8 mm? -67.78 -66.22 0.59 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.523 ' N ' ' O ' ' A' ' 49' ' ' VAL . 2.8 t70 78.0 -34.02 0.18 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.875 0.845 . . . . 0.0 109.627 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.536 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.4 p -20.15 134.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.169 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.481 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.453 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.3 tttt -69.9 36.42 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.133 -0.98 . . . . 0.0 110.457 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.494 ' NZ ' ' CB ' ' A' ' 56' ' ' LYS . 3.2 ttpm? -83.97 169.21 15.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.919 . . . . 0.0 108.531 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.535 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -79.71 123.54 27.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.021 -1.049 . . . . 0.0 109.545 -179.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.651 ' CZ3' ' CZ ' ' A' ' 92' ' ' PHE . 93.3 m95 -119.09 -48.54 2.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.453 -0.779 . . . . 0.0 109.934 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 p -45.51 -55.97 5.61 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.15 -0.968 . . . . 0.0 109.913 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -55.17 -32.17 61.95 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.535 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 8.8 m-70 -83.55 168.74 16.13 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.981 0.896 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.58 178.57 4.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.817 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -94.24 148.59 22.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.87 -1.144 . . . . 0.0 108.863 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.514 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.35 151.32 48.92 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.54 94.01 4.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.626 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.41 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 17.9 pt-20 -55.12 -24.2 24.86 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.316 -0.865 . . . . 0.0 111.028 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.534 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.4 mmtp -68.43 -8.81 43.99 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -133.76 -12.89 2.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.783 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 52.68 45.83 27.89 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -178.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -111.86 -173.61 2.28 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.311 0.577 . . . . 0.0 109.732 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.51 5.66 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 177.551 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 35.2 mt -59.81 82.6 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.047 0 O-C-N 120.661 -1.274 . . . . 0.0 110.745 -176.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.553 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -115.38 4.62 14.4 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.539 ' NZ ' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -80.59 72.08 7.49 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' HIS . 46.5 m -44.74 -53.09 7.72 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.204 -0.935 . . . . 0.0 109.742 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.518 ' CE1' ' HG ' ' B' ' 605' ' ' CYS . 45.5 m-70 -51.9 -179.31 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.362 -0.836 . . . . 0.0 109.134 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 23.3 m0 55.92 173.65 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.741 0.781 . . . . 0.0 109.124 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.692 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -131.2 -164.6 1.46 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.681 0.753 . . . . 0.0 109.24 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.563 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.1 mp -70.68 -58.4 3.69 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -43.77 -52.4 6.64 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.67 0.748 . . . . 0.0 109.702 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.692 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.0 mmtt -46.11 -54.43 8.59 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.628 0.727 . . . . 0.0 109.558 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.539 ' OH ' ' NZ ' ' A' ' 74' ' ' LYS . 2.2 m-85 -72.59 -42.05 64.98 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.143 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.19 6.1 14.07 Favored Glycine 0 N--CA 1.5 2.966 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.515 HG22 ' N ' ' A' ' 85' ' ' GLN . 52.0 mt -61.63 161.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.765 -0.844 . . . . 0.0 109.784 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.515 ' N ' HG22 ' A' ' 84' ' ' ILE . 0.0 OUTLIER -172.05 -162.91 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.19 70.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.368 -0.832 . . . . 0.0 109.956 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.416 ' OD2' ' O ' ' A' ' 87' ' ' ASP . 1.0 OUTLIER -68.42 -13.19 62.12 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -96.81 112.56 24.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -96.23 116.21 28.64 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.928 -1.107 . . . . 0.0 109.594 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.516 ' HG ' HD12 ' A' ' 20' ' ' LEU . 6.8 mt -91.99 175.73 6.76 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.514 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.7 mt-30 -134.68 160.34 38.44 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.651 ' CZ ' ' CZ3' ' A' ' 58' ' ' TRP . 0.1 OUTLIER -119.16 96.45 5.23 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.503 2.197 0 O-C-N 121.858 -0.526 . . . . 0.0 110.266 -177.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.524 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.7 m . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.6 mp -58.45 133.81 56.1 Favored 'General case' 0 C--N 1.293 -1.85 0 O-C-N 120.696 -1.253 . . . . 0.0 110.74 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.499 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.61 104.08 13.44 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.1 t -50.84 126.66 16.51 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 122.23 1.014 . . . . 0.0 109.728 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.37 5.5 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 106.216 -2.753 . . . . 0.0 106.216 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.7 m -105.72 -36.15 7.15 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.453 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.8 mm-40 55.65 56.2 6.42 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 122.719 1.247 . . . . 0.0 110.015 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -140.63 123.92 10.15 Favored Pre-proline 0 N--CA 1.497 1.88 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -44.07 133.94 8.52 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 CA-C-N 120.536 1.227 . . . . 0.0 114.488 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.524 ' N ' ' O ' ' B' ' 547' ' ' SER . 36.9 mt -91.85 98.53 8.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.77 92.13 5.17 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.203 -0.936 . . . . 0.0 111.338 -178.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.27 -95.24 0.15 Allowed Glycine 0 N--CA 1.488 2.118 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 10.0 mmt180 -114.2 151.13 33.23 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.1 p -144.45 126.25 15.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.944 -1.097 . . . . 0.0 111.676 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 41.0 mt -91.43 146.77 5.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.679 ' H ' ' HZ2' ' B' ' 584' ' ' LYS . 8.6 m -117.61 146.6 43.53 Favored 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.709 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.2 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.61 0.719 . . . . 0.0 109.389 -178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.549 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.9 mtp -65.96 26.44 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.709 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.12 -8.96 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 -178.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -82.14 161.92 22.65 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -103.77 174.66 5.77 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -161.09 135.07 6.89 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 118.03 -1.468 . . . . 0.0 110.089 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.586 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.8 m80 -55.53 116.0 10.79 Favored Pre-proline 0 C--N 1.301 -1.533 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.53 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 41.8 Cg_exo -46.46 -9.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.384 0 CA-C-N 120.27 1.132 . . . . 0.0 111.642 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.677 ' O ' HG13 ' B' ' 574' ' ' VAL . 10.4 mt-10 -99.75 -52.41 3.46 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.418 1.104 . . . . 0.0 109.738 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.47 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.6 m170 -59.06 -3.2 0.33 Allowed 'General case' 0 C--N 1.289 -2.028 0 O-C-N 120.41 -1.432 . . . . 0.0 109.618 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.48 ' H ' ' C ' ' B' ' 571' ' ' GLU . 23.2 t80 -132.38 58.86 1.74 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.677 HG13 ' O ' ' B' ' 571' ' ' GLU . 7.7 m -93.91 177.98 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.659 0.742 . . . . 0.0 110.777 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.617 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -75.52 145.64 41.17 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.95 75.7 3.11 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 116.661 -2.015 . . . . 0.0 109.935 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . 0.429 ' HE2' HG21 ' A' ' 49' ' ' VAL . 0.9 OUTLIER -153.1 -61.61 0.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 102.264 -3.236 . . . . 0.0 102.264 173.05 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.542 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.3 p -118.41 82.78 1.9 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 111.881 -2.418 . . . . 0.0 105.069 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mp -52.66 16.36 0.0 OUTLIER 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.75 -36.82 21.5 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 119.573 -1.954 . . . . 0.0 112.78 -178.153 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.53 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.2 tp60 -161.9 142.13 10.33 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 119.262 -2.149 . . . . 0.0 114.941 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.617 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.5 tp -140.38 167.63 21.7 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.526 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.7 m-20 -150.8 134.78 16.73 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.236 -0.915 . . . . 0.0 109.235 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.679 ' HZ2' ' H ' ' B' ' 562' ' ' THR . 1.8 ptpp? -52.58 -18.65 1.84 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.229 -0.919 . . . . 0.0 109.292 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.46 -18.19 57.43 Favored Glycine 0 N--CA 1.485 1.938 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.68 25.17 3.4 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.906 -0.761 . . . . 0.0 108.989 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.554 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -91.08 109.08 20.32 Favored 'General case' 0 N--CA 1.501 2.078 0 CA-C-O 122.564 1.173 . . . . 0.0 110.029 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -105.7 169.91 8.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 107.516 -1.291 . . . . 0.0 107.516 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.425 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.2 tt0 -152.62 157.19 40.63 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.737 -1.227 . . . . 0.0 110.616 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.503 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -157.1 146.52 20.35 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.606 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 47.89 22.93 0.41 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.923 -1.11 . . . . 0.0 109.59 -179.323 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.473 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 81.81 -7.03 1.43 Allowed 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.789 -0.57 . . . . 0.0 111.234 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . 0.402 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 38.3 mttm -89.59 121.07 69.5 Favored Pre-proline 0 C--N 1.297 -1.711 0 O-C-N 121.033 -1.042 . . . . 0.0 109.711 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.537 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.5 Cg_exo -49.61 164.18 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.235 0 CA-C-N 120.174 1.098 . . . . 0.0 111.656 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.537 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.6 m-85 -170.28 139.95 1.81 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.242 -0.911 . . . . 0.0 109.873 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 3.8 m -69.69 154.08 42.49 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 175.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.537 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.09 -57.59 12.39 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 178.357 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.8 -29.68 1.41 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 4.6 m -82.43 -67.55 0.78 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.639 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.32 -59.16 3.1 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.523 0.678 . . . . 0.0 110.224 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.65 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -50.44 -42.7 54.53 Favored 'General case' 0 C--N 1.293 -1.851 0 O-C-N 121.539 -0.725 . . . . 0.0 109.429 -178.567 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 8.7 tptp -62.78 -22.84 66.89 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.089 -1.007 . . . . 0.0 111.199 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.468 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -92.92 -44.69 8.32 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.325 -1.484 . . . . 0.0 110.26 -179.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.447 ' O ' ' C ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -120.06 32.85 5.85 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.528 -0.733 . . . . 0.0 109.831 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.518 ' HG ' ' CE1' ' A' ' 76' ' ' HIS . 0.8 OUTLIER . . . . . 0 N--CA 1.503 2.2 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.502 0 N-CA-C 108.542 -1.823 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.5 p -93.92 122.07 36.04 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.551 -0.97 . . . . 0.0 109.475 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.441 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -125.78 123.51 38.94 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.617 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.23 129.99 34.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 108.807 -179.806 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.446 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.34 131.46 35.06 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.66 34.68 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.287 -0.883 . . . . 0.0 110.098 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 33.1 t -136.39 106.96 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 CA-C-O 121.67 0.747 . . . . 0.0 109.21 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.502 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 5.9 m170 -77.81 103.43 7.75 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 178.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.564 HG13 ' CD1' ' A' ' 92' ' ' PHE . 2.1 t -69.35 107.38 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.621 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' LEU . 11.5 p -74.27 -65.31 0.86 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.542 -0.724 . . . . 0.0 111.122 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' OG1' ' A' ' 25' ' ' THR . 19.3 t0 -46.9 -13.15 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.088 -1.007 . . . . 0.0 110.027 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.549 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.5 mm? -112.12 -48.03 3.07 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.424 -0.797 . . . . 0.0 109.062 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER 98.02 13.06 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -177.531 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.426 HH21 ' HB2' ' A' ' 29' ' ' ARG . 5.1 mtp-105 -94.77 -176.85 4.0 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.125 0.965 . . . . 0.0 109.702 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.502 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 2.4 m-20 -138.34 116.02 11.41 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.438 HG12 ' N ' ' A' ' 32' ' ' THR . 42.6 t -113.15 155.96 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-O 121.532 0.682 . . . . 0.0 109.341 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -134.56 133.92 40.79 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.551 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.424 HD22 ' O ' ' A' ' 32' ' ' THR . 2.7 mm? -113.85 113.16 24.51 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -60.26 107.58 0.67 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.4 m -134.5 -169.77 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.822 0.82 . . . . 0.0 110.114 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.9 p -142.61 173.25 11.7 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.441 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -78.89 46.61 2.95 Favored Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.433 ' C ' HG21 ' A' ' 78' ' ' THR . 6.4 pt-20 -148.57 4.89 0.69 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.675 -0.897 . . . . 0.0 108.982 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.615 ' O ' HG22 ' A' ' 78' ' ' THR . 2.3 m -90.49 144.31 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.01 -1.057 . . . . 0.0 110.174 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.492 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 p-80 -84.47 146.45 27.6 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.924 -1.11 . . . . 0.0 108.797 178.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 68.3 mt -48.93 -53.68 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 120.937 -1.102 . . . . 0.0 108.683 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.72 -15.32 4.49 Favored Glycine 0 N--CA 1.485 1.945 0 N-CA-C 108.148 -1.981 . . . . 0.0 108.148 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -76.85 -30.62 55.67 Favored Glycine 0 N--CA 1.483 1.777 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -83.71 -43.47 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.61 -0.935 . . . . 0.0 108.62 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.58 -37.67 12.87 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.112 -0.992 . . . . 0.0 108.389 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -70.21 -61.06 1.92 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.657 -0.652 . . . . 0.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -53.89 -59.22 4.91 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.178 -0.952 . . . . 0.0 111.663 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.18 -44.3 10.76 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.072 -1.017 . . . . 0.0 110.088 -177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 52' ' ' LEU . 24.6 t -70.89 -46.76 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.138 -0.976 . . . . 0.0 109.418 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -44.7 -37.75 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.31 -0.869 . . . . 0.0 109.646 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.487 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 7.8 mtmp? -71.46 -33.8 69.65 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.446 -0.784 . . . . 0.0 109.585 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.1 tp -64.01 -67.9 0.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 t70 67.03 78.76 0.24 Allowed 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.807 0.813 . . . . 0.0 110.572 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.569 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -171.9 149.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.623 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.46 33.97 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.264 -0.897 . . . . 0.0 109.028 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.569 ' H ' ' C ' ' A' ' 54' ' ' VAL . 43.3 tttp -78.07 164.55 24.93 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.313 -0.867 . . . . 0.0 109.146 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.14 91.57 4.34 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.358 -0.838 . . . . 0.0 109.154 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -72.35 -52.05 17.87 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.566 ' C ' ' H ' ' A' ' 61' ' ' HIS . 76.1 p -47.82 -41.84 24.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.62 -0.675 . . . . 0.0 110.008 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -53.99 -4.83 0.06 Allowed 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.25 -0.907 . . . . 0.0 109.091 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.596 ' CG ' ' CE2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -119.12 161.62 20.0 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-O 122.008 0.909 . . . . 0.0 110.129 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . . . -169.99 165.56 9.45 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.76 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -93.35 132.88 37.16 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.603 -1.311 . . . . 0.0 109.637 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -119.73 147.85 44.1 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.618 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -108.29 93.0 4.29 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.112 -0.992 . . . . 0.0 108.551 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -54.95 -24.12 22.35 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.243 -0.911 . . . . 0.0 110.895 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.538 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 26.0 mmtt -68.58 -8.28 40.31 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -133.86 -12.75 2.56 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.553 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.9 OUTLIER 52.86 45.77 28.1 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -178.236 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -113.02 -173.2 2.2 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.423 0.63 . . . . 0.0 109.914 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.71 98.61 5.05 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 177.082 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.417 ' HB3' HD13 ' A' ' 41' ' ' ILE . 21.6 mt -60.67 82.98 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 O-C-N 120.86 -1.15 . . . . 0.0 110.449 -176.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -117.79 6.84 12.35 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.424 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -84.11 68.78 10.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.759 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.414 ' C ' ' O ' ' A' ' 74' ' ' LYS . 28.4 m -40.84 -38.5 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.542 -0.724 . . . . 0.0 110.073 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 15.4 m80 -58.72 171.45 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.266 -0.896 . . . . 0.0 108.964 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 16.7 m0 56.51 168.17 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.61 0.719 . . . . 0.0 109.737 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.665 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -121.7 -164.48 1.15 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.693 0.758 . . . . 0.0 109.477 -178.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 79' ' ' LEU . 4.8 mp -70.41 -59.44 2.86 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -42.82 -51.91 5.25 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.833 0.825 . . . . 0.0 109.755 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.665 ' CG ' ' H ' ' A' ' 78' ' ' THR . 23.0 mmtp -47.16 -54.68 10.05 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.742 0.782 . . . . 0.0 109.362 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.21 -43.37 74.26 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.345 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.77 4.23 17.24 Favored Glycine 0 N--CA 1.499 2.843 0 N-CA-C 108.176 -1.97 . . . . 0.0 108.176 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.535 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 45.4 mt -61.55 161.21 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.772 -0.84 . . . . 0.0 109.331 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.535 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -173.15 -166.29 0.34 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.463 -0.773 . . . . 0.0 109.134 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.38 -22.83 64.63 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.409 -0.807 . . . . 0.0 109.968 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -77.41 -11.37 59.83 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.03 113.03 25.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -97.08 118.09 32.72 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.095 -1.003 . . . . 0.0 109.541 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.9 mt -94.63 177.13 6.02 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 4.8 mt-30 -132.89 158.61 42.12 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.329 -1.359 . . . . 0.0 107.329 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.596 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -101.33 109.35 21.18 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 62' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.806 0 O-C-N 120.555 -1.34 . . . . 0.0 109.459 -177.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.534 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -59.96 135.57 57.75 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 120.938 -1.102 . . . . 0.0 110.431 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.485 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.58 103.93 13.3 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 178.196 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.3 t -51.28 127.08 18.58 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.245 1.021 . . . . 0.0 109.727 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.6 -34.79 5.27 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 106.206 -2.758 . . . . 0.0 106.206 -177.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.5 m -105.4 -35.93 7.34 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.448 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.9 mm-40 55.92 56.49 5.96 Favored 'General case' 0 C--N 1.3 -1.557 0 CA-C-O 122.694 1.235 . . . . 0.0 110.079 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp -140.47 123.6 10.14 Favored Pre-proline 0 N--CA 1.496 1.84 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -44.2 134.99 8.66 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.519 1.221 . . . . 0.0 114.743 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.1 mt -94.22 98.29 7.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.6 p -99.85 91.17 4.7 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.218 -0.926 . . . . 0.0 111.25 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.77 -95.9 0.15 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 107.584 -2.206 . . . . 0.0 107.584 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.474 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 11.5 mmt180 -112.48 151.31 30.08 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 22.3 p -144.77 126.29 15.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.957 -1.089 . . . . 0.0 111.438 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.97 146.65 5.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.886 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.4 m -118.28 146.78 44.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-O 121.853 0.835 . . . . 0.0 109.158 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.741 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.69 -129.11 0.26 Allowed 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 121.601 0.715 . . . . 0.0 109.441 -178.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 8.4 mtp -65.75 26.07 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.741 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.14 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.95 162.67 22.61 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -104.87 174.56 5.82 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.24 134.0 7.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.417 -1.427 . . . . 0.0 110.24 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.6 m80 -54.04 114.09 5.98 Favored Pre-proline 0 C--N 1.303 -1.443 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 176.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.585 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 37.0 Cg_exo -46.85 -11.45 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.381 1.172 . . . . 0.0 111.218 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.897 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.7 mt-10 -95.43 -51.79 4.42 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.046 0.927 . . . . 0.0 110.185 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.536 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.1 m170 -60.21 -3.56 0.64 Allowed 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.982 -1.074 . . . . 0.0 109.859 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.42 ' H ' ' C ' ' B' ' 571' ' ' GLU . 24.2 t80 -130.31 57.95 1.69 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.897 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.32 178.04 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-O 121.74 0.781 . . . . 0.0 111.167 -178.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.664 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.93 145.35 30.36 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.169 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -93.56 75.48 4.4 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.794 -1.962 . . . . 0.0 109.239 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -153.46 -64.74 0.15 Allowed 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 102.163 -3.273 . . . . 0.0 102.163 173.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.555 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -114.28 79.43 1.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 111.897 -2.411 . . . . 0.0 104.583 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 9.4 mt -52.86 16.0 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.84 -36.61 15.93 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 119.739 -1.851 . . . . 0.0 112.459 -178.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.585 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.1 tp60 -158.83 140.1 13.13 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 119.562 -1.961 . . . . 0.0 114.822 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.664 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.1 tp -137.94 169.51 17.66 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.435 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.2 m-20 -148.0 130.79 16.06 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.285 -0.884 . . . . 0.0 109.041 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.886 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 0.6 OUTLIER -52.13 -17.2 0.99 Allowed 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.432 -0.793 . . . . 0.0 109.606 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.39 -20.6 51.54 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.24 27.59 4.13 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.85 108.78 19.91 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.589 1.185 . . . . 0.0 109.979 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.506 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.51 168.22 9.64 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.72 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.431 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.95 157.29 40.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.707 -1.246 . . . . 0.0 110.693 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.542 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 3.2 tp60 -155.25 145.96 22.28 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.532 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.0 23.66 0.09 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.09 -1.006 . . . . 0.0 109.97 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 83.43 -6.48 1.17 Allowed 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.828 -0.545 . . . . 0.0 110.869 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -88.0 118.68 69.92 Favored Pre-proline 0 C--N 1.294 -1.816 0 O-C-N 121.279 -0.888 . . . . 0.0 109.559 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.513 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 37.0 Cg_exo -49.41 165.58 0.24 Allowed 'Trans proline' 0 N--CA 1.489 1.209 0 CA-C-N 120.089 1.067 . . . . 0.0 111.808 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.513 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.9 m-85 -170.82 137.66 1.29 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.133 -0.979 . . . . 0.0 110.473 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 28.5 m -70.36 155.63 40.41 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 104.247 -2.501 . . . . 0.0 104.247 174.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.569 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.11 -57.55 12.55 Favored 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 117.563 -1.655 . . . . 0.0 107.001 179.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -29.77 1.42 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 89.9 m -80.04 -65.62 0.98 Allowed 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.288 -0.882 . . . . 0.0 108.791 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.578 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.68 -55.86 17.02 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.751 -0.593 . . . . 0.0 110.048 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.692 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -47.06 -39.08 12.22 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.296 -0.877 . . . . 0.0 108.792 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt -67.91 -20.38 65.08 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.57 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 9.6 mt -90.66 -56.84 3.04 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.542 -1.349 . . . . 0.0 111.937 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.542 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 6.2 m-85 -91.61 -29.24 17.02 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.672 -1.268 . . . . 0.0 110.351 -178.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.422 ' O ' HD12 ' B' ' 601' ' ' LEU . 74.2 m . . . . . 0 N--CA 1.501 2.091 0 CA-C-O 118.062 -0.971 . . . . 0.0 109.448 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.493 2.473 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -85.46 122.83 30.16 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.435 -1.038 . . . . 0.0 109.274 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.417 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -131.79 123.15 27.02 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 179.258 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.14 129.82 35.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.982 . . . . 0.0 108.592 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.504 HD21 HG22 ' A' ' 84' ' ' ILE . 0.1 OUTLIER -83.31 131.57 35.07 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -77.85 145.63 36.17 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.444 -0.903 . . . . 0.0 109.296 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.1 t -138.93 113.53 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-O 121.868 0.842 . . . . 0.0 109.909 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.508 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 7.6 m170 -85.83 103.5 14.64 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.525 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -72.44 99.3 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 27' ' ' LEU . 59.2 p -73.67 -38.3 64.99 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.533 -0.729 . . . . 0.0 109.968 -178.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.41 18.16 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.061 -1.024 . . . . 0.0 108.627 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.9 mt -152.03 -30.53 0.16 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 84.7 13.61 0.24 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 122.248 -0.282 . . . . 0.0 110.351 -179.784 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -98.42 -178.2 3.94 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 120.954 -1.091 . . . . 0.0 109.952 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.508 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 32.1 m-20 -138.97 117.57 12.16 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.41 HG12 ' N ' ' A' ' 32' ' ' THR . 20.9 t -117.97 157.3 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-O 121.629 0.728 . . . . 0.0 110.096 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.443 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.79 135.33 43.79 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 179.686 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.538 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 2.4 mm? -116.51 112.29 21.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.566 -0.709 . . . . 0.0 109.336 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -60.66 103.92 0.3 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.414 ' HB ' HG11 ' A' ' 39' ' ' VAL . 22.1 m -136.28 -170.64 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.972 0.891 . . . . 0.0 110.338 -178.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.417 ' OG1' ' CG ' ' A' ' 38' ' ' GLU . 5.6 p -143.06 176.3 9.2 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.6 45.72 2.94 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.433 ' C ' HG21 ' A' ' 78' ' ' THR . 3.2 pt-20 -144.97 -0.13 0.92 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.295 -1.121 . . . . 0.0 108.605 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.455 ' O ' HG22 ' A' ' 78' ' ' THR . 1.7 m -87.89 134.11 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 121.006 -1.059 . . . . 0.0 109.81 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 m-70 -69.61 139.41 53.62 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 121.1 -1.0 . . . . 0.0 108.823 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.436 ' C ' ' N ' ' A' ' 43' ' ' GLY . 14.7 mt -47.31 -58.55 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.0 109.322 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.454 ' H ' HG22 ' A' ' 75' ' ' THR . . . -55.51 -13.19 5.38 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 108.219 -1.952 . . . . 0.0 108.219 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.84 -24.95 73.02 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 6.4 t -83.67 -38.5 14.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.482 ' O ' HG23 ' A' ' 49' ' ' VAL . 31.6 mtm -48.41 -37.39 16.88 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.426 ' CD1' HD13 ' B' ' 603' ' ' LEU . 2.1 tp -73.57 -61.27 1.89 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.738 -0.602 . . . . 0.0 110.788 -178.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -53.49 -61.27 2.41 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.214 -0.929 . . . . 0.0 110.889 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.6 tp -49.74 -35.06 20.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.277 -0.889 . . . . 0.0 109.416 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 45' ' ' MET . 9.2 t -73.02 -48.6 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.33 -0.856 . . . . 0.0 108.767 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -44.71 -37.44 3.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.536 -0.727 . . . . 0.0 109.559 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.538 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 55.5 mttp -71.16 -34.75 71.27 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.449 -0.782 . . . . 0.0 110.355 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.46 HD12 ' CG1' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.73 -63.24 1.33 Allowed 'General case' 0 C--N 1.306 -1.283 0 O-C-N 120.953 -1.092 . . . . 0.0 109.062 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 t70 69.54 78.3 0.21 Allowed 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.884 0.85 . . . . 0.0 109.895 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.553 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -171.51 147.42 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 C-N-CA 119.951 -0.699 . . . . 0.0 110.391 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -68.96 35.37 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.444 -0.785 . . . . 0.0 108.959 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.553 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.4 ttmm -78.34 154.64 30.65 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.12 -0.988 . . . . 0.0 108.817 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.22 97.75 0.75 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 108.767 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.541 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 45.7 m0 -80.45 -45.19 18.01 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.809 -0.557 . . . . 0.0 110.095 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.2 t -56.39 -56.61 19.03 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.995 -1.066 . . . . 0.0 110.399 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -49.83 -24.63 2.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.16 -0.963 . . . . 0.0 108.881 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.541 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -73.36 148.17 43.66 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.961 0.886 . . . . 0.0 109.731 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -160.68 152.6 19.94 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.826 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -94.79 143.06 26.76 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.141 -0.975 . . . . 0.0 109.716 -179.088 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.531 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.23 137.4 52.88 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.5 t90 -95.77 89.78 5.42 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.589 -0.694 . . . . 0.0 109.425 -179.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.477 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 14.4 pt-20 -53.98 -23.78 14.39 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.176 -0.952 . . . . 0.0 110.298 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.497 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.5 mmtp -63.91 -10.8 22.95 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.471 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -134.95 -12.3 2.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.212 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.6 44.95 29.07 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -110.03 -174.15 2.42 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.515 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.92 99.6 5.58 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 177.529 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.6 mt -59.88 83.75 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.053 0 CA-C-O 122.361 1.077 . . . . 0.0 110.662 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.5 6.69 10.07 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.133 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.444 ' CB ' ' NZ ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.73 74.04 5.27 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.21 -0.931 . . . . 0.0 109.542 -179.472 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.562 HG21 ' O ' ' B' ' 602' ' ' LYS . 11.8 p -75.93 -18.55 59.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.285 -0.884 . . . . 0.0 109.882 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -76.76 36.54 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.117 -0.989 . . . . 0.0 110.25 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -175.57 -143.81 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -152.96 149.53 28.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.851 -1.781 . . . . 0.0 109.506 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.681 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.3 pt? -40.2 -48.63 2.59 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.196 -0.94 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.423 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 18.0 t70 -47.23 -33.46 5.47 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.171 -0.956 . . . . 0.0 109.574 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.563 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.73 -31.08 70.77 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.563 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -79.02 -50.93 10.3 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 178.629 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.1 9.39 6.13 Favored Glycine 0 N--CA 1.509 3.562 0 N-CA-C 108.898 -1.681 . . . . 0.0 108.898 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.546 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 56.4 mt -60.63 161.35 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.546 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.47 -168.68 1.57 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.255 -0.903 . . . . 0.0 109.074 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.34 -23.04 65.58 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.284 -0.885 . . . . 0.0 110.157 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -2.24 56.99 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.196 -0.94 . . . . 0.0 108.908 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.481 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.37 113.03 25.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.527 -0.733 . . . . 0.0 109.641 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp -98.32 115.55 28.67 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.995 -1.066 . . . . 0.0 109.741 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.7 mt -95.38 176.11 6.32 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -133.58 156.63 47.48 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.538 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 2.2 t80 -115.21 126.4 54.51 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 O-C-N 120.992 -1.068 . . . . 0.0 110.274 -178.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.536 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -58.15 135.67 57.1 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.893 -1.129 . . . . 0.0 110.375 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.53 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.01 104.12 13.82 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 178.467 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.52 125.4 11.24 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 122.077 0.941 . . . . 0.0 109.695 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -33.86 5.83 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 106.569 -2.612 . . . . 0.0 106.569 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.1 m -106.3 -35.52 7.13 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 54.97 56.65 6.38 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.793 1.283 . . . . 0.0 109.937 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -140.66 123.77 10.04 Favored Pre-proline 0 C--N 1.295 -1.78 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -44.1 134.03 8.57 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 CA-C-N 120.461 1.2 . . . . 0.0 114.674 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.536 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.2 mt -92.65 98.37 8.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.9 p -99.71 91.16 4.73 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.301 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.1 -96.01 0.15 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.433 -2.267 . . . . 0.0 107.433 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -113.2 150.9 31.66 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.53 126.48 15.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.0 -1.062 . . . . 0.0 111.384 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.3 mt -90.57 146.21 6.47 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.3 m -121.21 146.4 46.84 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-O 121.982 0.896 . . . . 0.0 108.968 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.734 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -124.56 -127.9 0.25 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-O 122.092 0.949 . . . . 0.0 108.783 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 0.0 OUTLIER -65.51 28.1 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.734 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 103.43 -8.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 149.64 26.75 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -95.69 174.86 6.77 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -160.36 134.02 6.99 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 118.289 -1.365 . . . . 0.0 110.077 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.59 ' O ' ' N ' ' B' ' 571' ' ' GLU . 6.0 m80 -55.65 115.84 10.49 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 177.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 53.0 Cg_exo -45.32 -9.5 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.43 0 CA-C-N 120.298 1.142 . . . . 0.0 112.141 -178.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.931 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.3 mt-10 -102.03 -52.55 3.14 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 122.059 0.933 . . . . 0.0 109.978 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.515 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 16.7 m170 -56.88 -3.96 0.14 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.862 -1.149 . . . . 0.0 109.992 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.464 ' H ' ' C ' ' B' ' 571' ' ' GLU . 20.6 t80 -126.6 55.6 1.52 Allowed 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.931 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.1 m -94.25 177.68 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-O 121.711 0.767 . . . . 0.0 110.818 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.579 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.62 145.06 33.27 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.45 74.21 3.28 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 116.621 -2.031 . . . . 0.0 109.03 178.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.34 -47.45 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 102.87 -3.011 . . . . 0.0 102.87 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.572 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.6 p -132.95 81.28 1.93 Allowed 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.282 -2.236 . . . . 0.0 104.975 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 1.074 HD13 ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.67 15.5 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -176.459 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.09 -36.95 17.83 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 119.474 -2.016 . . . . 0.0 112.69 -178.302 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -160.36 140.1 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 119.416 -2.052 . . . . 0.0 114.969 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.579 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.6 tp -139.53 169.3 18.0 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.455 ' O ' ' N ' ' B' ' 587' ' ' PHE . 71.8 m-20 -145.62 130.55 18.23 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.159 -0.963 . . . . 0.0 108.864 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -52.44 -21.38 3.62 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.433 -0.792 . . . . 0.0 109.577 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.2 -16.35 60.94 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.6 p -134.66 26.27 3.7 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.906 -0.761 . . . . 0.0 108.971 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -88.64 109.69 20.32 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 122.443 1.116 . . . . 0.0 109.484 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.46 162.55 12.96 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.2 tt0 -153.83 156.89 38.48 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.558 1.17 . . . . 0.0 111.026 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.498 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 4.4 tt0 -156.46 141.52 17.25 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 105.985 -1.857 . . . . 0.0 105.985 178.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.706 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.95 25.81 3.32 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 120.846 -1.159 . . . . 0.0 109.288 178.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.8 m-20 79.85 -7.7 1.64 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.708 -0.62 . . . . 0.0 111.365 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . 0.458 ' O ' ' CE2' ' B' ' 595' ' ' TYR . 15.9 mttt -86.99 115.69 63.47 Favored Pre-proline 0 C--N 1.295 -1.791 0 O-C-N 121.153 -0.967 . . . . 0.0 110.282 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.597 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 32.7 Cg_exo -53.31 160.53 4.7 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 CA-C-N 119.969 1.025 . . . . 0.0 111.979 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.597 ' CD1' ' O ' ' B' ' 594' ' ' PRO . 51.8 m-85 -168.19 135.59 2.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.623 -0.673 . . . . 0.0 110.167 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.7 m -65.53 154.97 37.12 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 175.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.58 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.73 -57.35 13.06 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 178.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.09 -29.18 1.41 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 17.8 m -81.81 -61.18 1.99 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.537 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -56.59 -52.26 65.51 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.207 0.527 . . . . 0.0 110.133 -179.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.687 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -50.95 -43.33 60.26 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.055 -1.028 . . . . 0.0 109.072 -178.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.562 ' O ' HG21 ' A' ' 75' ' ' THR . 0.6 OUTLIER -55.59 -21.2 16.34 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.558 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.426 HD13 ' CD1' ' A' ' 46' ' ' LEU . 1.7 mt -94.24 -56.41 2.85 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.86 -1.15 . . . . 0.0 111.111 -178.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.487 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 23.9 m-85 -94.91 5.5 51.73 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.934 -1.104 . . . . 0.0 110.11 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.487 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 20.0 m . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.958 -1.089 . . . . 0.0 109.41 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.9 p -91.09 122.84 34.07 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.714 -0.874 . . . . 0.0 109.987 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -129.66 121.49 27.09 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.613 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.84 128.93 35.51 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.247 -0.908 . . . . 0.0 108.875 -179.664 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.546 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -83.67 132.3 34.89 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.411 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.56 145.71 34.67 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.726 -0.79 . . . . 0.0 110.22 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.9 t -135.4 103.97 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 CA-C-O 121.586 0.707 . . . . 0.0 109.49 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -78.05 104.48 8.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 178.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.547 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.4 t -69.83 108.77 2.21 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.003 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.8 p -77.42 162.86 26.89 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.4 t0 73.16 -43.74 0.57 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.49 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.4 mt -92.73 -36.67 12.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 78.53 18.17 1.02 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -93.04 -178.94 4.95 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.834 -1.166 . . . . 0.0 109.436 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -137.93 113.87 9.9 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.2 t -110.58 152.37 12.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 CA-C-O 121.59 0.71 . . . . 0.0 109.45 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.448 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.82 130.52 38.05 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.448 HD22 ' C ' ' A' ' 32' ' ' THR . 2.9 mm? -114.22 112.98 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.687 -0.633 . . . . 0.0 109.39 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -59.79 105.63 0.4 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 m -135.37 -170.39 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 CA-C-O 121.812 0.815 . . . . 0.0 110.13 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 p -142.12 175.03 10.06 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.61 47.87 3.1 Favored Glycine 0 N--CA 1.483 1.799 0 N-CA-C 109.068 -1.613 . . . . 0.0 109.068 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.437 ' C ' HG21 ' A' ' 78' ' ' THR . 0.0 OUTLIER -147.38 -3.57 0.55 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.482 -1.01 . . . . 0.0 108.998 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 m -86.55 128.28 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.062 -1.024 . . . . 0.0 110.081 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 43' ' ' GLY . 5.6 m-70 -63.36 149.76 45.04 Favored 'General case' 0 C--N 1.29 -1.992 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.985 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.446 ' C ' ' N ' ' A' ' 43' ' ' GLY . 25.4 mt -49.64 -54.69 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.972 -1.08 . . . . 0.0 108.523 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.653 ' H ' HG23 ' A' ' 75' ' ' THR . . . -56.06 -12.2 5.34 Favored Glycine 0 C--N 1.299 -1.526 0 N-CA-C 108.139 -1.984 . . . . 0.0 108.139 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -65.69 -27.46 72.68 Favored Glycine 0 N--CA 1.482 1.703 0 N-CA-C 107.357 -2.297 . . . . 0.0 107.357 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -83.68 -44.81 18.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 34.1 mtm -46.96 -37.16 8.61 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -67.48 -65.67 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.347 0.594 . . . . 0.0 110.57 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -53.36 -53.38 51.9 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.391 -0.818 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -45.54 -59.24 2.83 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.723 -1.236 . . . . 0.0 109.687 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.726 HG22 ' CD2' ' A' ' 58' ' ' TRP . 85.1 t -54.25 -51.45 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.849 -1.157 . . . . 0.0 109.749 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -44.79 -40.22 5.92 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.355 -0.841 . . . . 0.0 110.145 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -68.21 -57.57 5.81 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.157 -0.964 . . . . 0.0 111.275 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.406 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.9 OUTLIER -62.11 -66.33 0.56 Allowed 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.82 -1.175 . . . . 0.0 109.014 -179.162 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.0 t70 72.38 82.54 0.14 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.928 0.871 . . . . 0.0 109.914 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.522 ' C ' ' H ' ' A' ' 56' ' ' LYS . 1.7 p -167.05 150.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.146 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.815 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -68.36 35.02 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.499 -0.75 . . . . 0.0 110.139 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.522 ' H ' ' C ' ' A' ' 54' ' ' VAL . 3.2 ttpm? -81.78 155.56 25.38 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.082 -1.011 . . . . 0.0 109.512 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -49.66 112.43 0.65 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.274 -0.891 . . . . 0.0 109.649 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.726 ' CD2' HG22 ' A' ' 49' ' ' VAL . 30.1 m95 -125.09 -30.31 3.22 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.562 -0.711 . . . . 0.0 110.045 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -56.6 13.72 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 120.914 -1.116 . . . . 0.0 110.797 -178.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -69.4 -4.0 16.62 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.106 -0.997 . . . . 0.0 110.396 -178.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.99 153.62 40.85 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.133 0.968 . . . . 0.0 110.676 -179.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -167.87 155.52 8.57 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.832 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.6 mm? -93.73 148.42 22.13 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.893 -1.13 . . . . 0.0 109.708 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.543 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.48 148.68 50.31 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.023 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.548 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -107.96 91.45 3.65 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.073 -1.017 . . . . 0.0 108.43 -178.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -55.23 -22.53 18.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.122 -0.986 . . . . 0.0 111.203 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.482 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -65.18 -18.61 65.45 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.177 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -123.95 -13.07 7.43 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.428 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.548 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.54 46.29 26.41 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 -177.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 t -113.49 -172.5 2.08 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.473 0.654 . . . . 0.0 109.851 -178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.475 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.64 104.38 8.35 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 177.672 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.446 ' HB3' HD13 ' A' ' 41' ' ' ILE . 46.2 mt -62.86 83.95 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.256 0 O-C-N 120.474 -1.391 . . . . 0.0 110.995 -176.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.475 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -119.02 6.73 11.32 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.482 ' O ' ' N ' ' A' ' 76' ' ' HIS . 5.9 mmpt? -76.36 32.76 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.653 HG23 ' H ' ' A' ' 42' ' ' GLY . 7.2 m -50.52 -10.08 0.06 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.102 -0.999 . . . . 0.0 109.661 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.487 ' CD2' ' CE3' ' A' ' 77' ' ' TRP . 5.0 t60 -53.47 -65.93 0.48 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.233 -0.917 . . . . 0.0 109.265 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -85.73 -143.16 0.1 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.572 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.638 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -130.47 169.67 15.22 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.661 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -60.19 -50.34 74.04 Favored 'General case' 0 C--N 1.287 -2.142 0 O-C-N 121.327 -0.858 . . . . 0.0 109.952 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.453 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 19.9 t70 -43.89 -35.89 2.17 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-O 122.19 0.995 . . . . 0.0 109.124 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.638 ' CG ' ' H ' ' A' ' 78' ' ' THR . 44.5 mmtt -65.12 -51.35 61.76 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -44.89 95.71 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 115.14 37.29 1.13 Allowed Glycine 0 N--CA 1.511 3.695 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.543 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 56.8 mt -92.96 161.98 2.46 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -165.01 -166.03 0.97 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.259 -0.9 . . . . 0.0 109.465 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.92 -22.08 64.18 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.461 -0.774 . . . . 0.0 109.784 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -5.48 58.15 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.31 -0.869 . . . . 0.0 108.779 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.33 112.44 24.62 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.537 -0.727 . . . . 0.0 109.196 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -97.2 115.4 27.52 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.996 -1.065 . . . . 0.0 109.61 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.546 ' HG ' HD12 ' A' ' 20' ' ' LEU . 7.1 mt -93.42 176.18 6.48 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.543 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.0 mt-30 -135.19 157.15 47.66 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.476 ' CD2' ' C ' ' A' ' 92' ' ' PHE . 0.6 OUTLIER -105.76 131.86 52.6 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.365 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.052 0 O-C-N 120.95 -1.094 . . . . 0.0 109.196 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.6 m . . . . . 0 N--CA 1.488 1.447 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.68 134.68 57.32 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.808 -1.183 . . . . 0.0 110.216 -178.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.498 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.37 104.03 13.21 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.6 t -50.88 127.03 17.55 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 122.174 0.988 . . . . 0.0 109.668 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.59 -34.65 5.35 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 106.081 -2.807 . . . . 0.0 106.081 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -105.58 -35.94 7.27 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.455 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.2 mm-40 55.07 56.39 6.61 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.73 1.252 . . . . 0.0 109.914 -178.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -140.57 123.7 10.09 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -44.31 134.83 9.0 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 CA-C-N 120.446 1.195 . . . . 0.0 114.633 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.1 mt -93.9 98.41 8.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . 0.409 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -99.54 91.26 4.82 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.258 -0.901 . . . . 0.0 111.208 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.46 -96.12 0.15 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 107.396 -2.282 . . . . 0.0 107.396 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.472 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.15 151.15 31.23 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.5 p -144.55 126.28 15.2 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.462 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.85 146.62 5.98 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.579 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 8.3 m -117.93 146.77 43.73 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.743 0.782 . . . . 0.0 109.041 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.51 -129.36 0.26 Allowed 'General case' 0 C--N 1.294 -1.814 0 CA-C-O 121.598 0.713 . . . . 0.0 109.228 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 4.0 mtt -65.84 26.27 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.33 -9.11 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -81.75 162.58 22.89 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.63 174.97 5.65 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.213 -1.402 . . . . 0.0 107.213 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.99 133.7 6.22 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 117.986 -1.486 . . . . 0.0 110.257 -178.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.594 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.7 m80 -54.32 115.17 7.88 Favored Pre-proline 0 C--N 1.304 -1.393 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 177.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.532 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.1 Cg_exo -45.38 -8.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 CA-C-N 120.278 1.135 . . . . 0.0 112.412 -178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.729 ' O ' HG13 ' B' ' 574' ' ' VAL . 8.5 mt-10 -104.11 -53.12 2.8 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 122.154 0.978 . . . . 0.0 109.757 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.516 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.6 m170 -54.73 -5.55 0.09 Allowed 'General case' 0 C--N 1.293 -1.86 0 O-C-N 120.431 -1.418 . . . . 0.0 109.734 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.491 ' H ' ' C ' ' B' ' 571' ' ' GLU . 15.9 t80 -125.45 53.46 1.54 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.729 HG13 ' O ' ' B' ' 571' ' ' GLU . 12.5 m -93.5 176.75 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.622 -0.674 . . . . 0.0 109.94 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.591 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.12 142.03 36.77 Favored 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.14 74.83 4.04 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 116.58 -2.048 . . . . 0.0 109.774 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.96 -57.87 0.15 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 101.655 -3.461 . . . . 0.0 101.655 172.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.552 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.1 p -122.39 78.48 1.51 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 111.922 -2.399 . . . . 0.0 104.738 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 0.631 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.8 mp -52.01 16.3 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -176.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.552 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.37 -37.42 21.56 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 119.476 -2.015 . . . . 0.0 112.328 -178.406 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.532 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -161.32 143.39 11.97 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 119.474 -2.016 . . . . 0.0 114.199 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.591 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.7 tp -138.95 170.69 15.53 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.452 ' O ' ' N ' ' B' ' 587' ' ' PHE . 69.0 m-20 -146.56 137.87 24.37 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.263 -0.898 . . . . 0.0 109.394 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.579 ' CE ' ' H ' ' B' ' 562' ' ' THR . 6.1 ptpp? -55.29 -22.43 18.67 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.582 0.706 . . . . 0.0 110.09 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.05 -17.06 59.96 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -131.18 23.56 4.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.967 -0.725 . . . . 0.0 109.344 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.538 ' O ' ' CG ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.7 113.02 25.0 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 122.235 1.017 . . . . 0.0 109.341 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -107.25 165.0 11.7 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 179.022 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.45 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.4 tt0 -152.13 156.99 40.93 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.719 1.247 . . . . 0.0 110.47 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.642 ' NE2' ' CE2' ' B' ' 600' ' ' PHE . 0.0 OUTLIER -160.96 146.55 14.44 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.589 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.37 22.82 0.5 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.749 -1.219 . . . . 0.0 109.425 -178.718 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.0 m-20 79.91 -6.38 1.77 Allowed 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.636 -0.665 . . . . 0.0 111.448 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . 0.52 ' O ' ' CE1' ' B' ' 595' ' ' TYR . 33.3 mttm -88.96 115.89 64.8 Favored Pre-proline 0 C--N 1.294 -1.832 0 O-C-N 121.064 -1.022 . . . . 0.0 110.121 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.562 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.0 Cg_exo -51.54 163.14 1.23 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 119.998 1.035 . . . . 0.0 112.369 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.562 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 66.4 m-85 -169.78 142.31 2.44 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.449 -0.782 . . . . 0.0 110.099 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 5.9 m -67.42 154.86 40.38 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.543 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.07 -58.01 10.54 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -48.29 -24.96 1.35 Allowed 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.629 -0.669 . . . . 0.0 110.025 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . 0.413 ' O ' ' HG ' ' B' ' 603' ' ' LEU . 1.4 m -77.08 -65.69 0.92 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.23 -0.919 . . . . 0.0 110.432 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.642 ' CE2' ' NE2' ' B' ' 590' ' ' GLN . 2.1 t80 -70.81 -40.49 72.45 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.848 -1.157 . . . . 0.0 111.261 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.687 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -52.11 -42.94 63.68 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.455 ' O ' HG21 ' A' ' 75' ' ' THR . 18.9 tptm -54.84 -25.33 27.83 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' B' ' 600' ' ' PHE . 11.6 mt -95.29 -57.95 2.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.477 -0.764 . . . . 0.0 111.652 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.494 ' CD1' ' CE2' ' B' ' 600' ' ' PHE . 13.0 m-85 -100.81 32.62 3.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.97 -1.082 . . . . 0.0 110.268 -179.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 109.698 179.526 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.123 0 N-CA-C 108.506 -1.838 . . . . 0.0 108.506 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 17' ' ' THR . 4.8 t -103.57 122.43 44.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.752 -0.852 . . . . 0.0 109.736 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.512 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -119.2 128.19 53.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.11 136.19 36.48 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.375 -0.828 . . . . 0.0 110.074 -179.392 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.492 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.45 132.78 34.16 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.319 -1.364 . . . . 0.0 107.319 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.96 145.49 36.03 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.788 -1.195 . . . . 0.0 108.234 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.9 t -140.46 115.96 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.719 0.771 . . . . 0.0 110.303 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -88.6 103.69 16.15 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.574 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -68.96 108.31 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.527 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.3 p -75.62 -55.94 5.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.274 -0.891 . . . . 0.0 110.566 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.546 ' CB ' ' NE2' ' A' ' 61' ' ' HIS . 25.6 t0 -58.24 1.06 0.06 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.039 -1.038 . . . . 0.0 109.824 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.6 mt -134.51 -25.09 1.52 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.341 -0.849 . . . . 0.0 109.433 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.14 14.26 2.53 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.923 -0.486 . . . . 0.0 110.199 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -94.04 -178.07 4.52 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.871 -1.143 . . . . 0.0 109.836 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -136.76 119.12 15.71 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.448 HG12 ' N ' ' A' ' 32' ' ' THR . 23.1 t -122.54 157.8 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-O 121.658 0.742 . . . . 0.0 110.065 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.493 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.07 133.42 42.97 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -179.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.493 HD22 ' C ' ' A' ' 32' ' ' THR . 3.9 mm? -115.27 113.12 23.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.618 -0.676 . . . . 0.0 110.151 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.445 ' CA ' ' HE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -58.52 114.05 2.29 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.001 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.4 m -140.88 -170.2 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-O 121.967 0.889 . . . . 0.0 110.498 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.5 p -144.18 175.3 10.17 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.92 43.79 3.03 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.477 ' C ' HG21 ' A' ' 78' ' ' THR . 7.3 pt-20 -145.25 5.14 1.09 Allowed 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.573 ' O ' HG22 ' A' ' 78' ' ' THR . 2.6 m -89.97 136.81 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.015 -1.053 . . . . 0.0 109.993 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m-70 -75.31 141.87 43.33 Favored 'General case' 0 C--N 1.292 -1.924 0 O-C-N 120.96 -1.088 . . . . 0.0 108.232 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 32.3 mt -47.07 -57.99 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.001 -1.062 . . . . 0.0 109.654 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.554 ' H ' HG23 ' A' ' 75' ' ' THR . . . -54.05 -13.49 3.56 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 108.143 -1.983 . . . . 0.0 108.143 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.6 -28.89 64.52 Favored Glycine 0 N--CA 1.485 1.944 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.8 t -83.74 -39.01 14.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.458 ' O ' HG23 ' A' ' 49' ' ' VAL . 27.7 mtm -46.47 -39.88 11.43 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.623 HD12 HD13 ' B' ' 603' ' ' LEU . 0.4 OUTLIER -78.33 -58.1 3.43 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.52 -0.737 . . . . 0.0 110.535 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.41 ' CB ' HD12 ' A' ' 33' ' ' LEU . 39.0 mttm -47.89 -59.34 3.41 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.775 -1.203 . . . . 0.0 109.893 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 36.0 tp -45.75 -38.28 6.85 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.337 -0.852 . . . . 0.0 109.391 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 45' ' ' MET . 81.4 t -78.37 -42.39 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.155 -0.966 . . . . 0.0 109.403 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.429 ' O ' ' OD1' ' A' ' 53' ' ' ASP . 39.5 mm-40 -46.54 -39.92 11.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.272 -0.892 . . . . 0.0 109.276 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.485 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.0 mtmp? -74.78 -34.01 62.37 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.52 -69.02 0.51 Allowed 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 50' ' ' GLU . 91.2 m-20 52.8 68.09 0.89 Allowed 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.17 0.509 . . . . 0.0 109.725 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.618 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.7 OUTLIER -136.42 32.06 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 122.0 0.905 . . . . 0.0 109.927 -178.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.42 ' HG3' HD12 ' B' ' 579' ' ' LEU . 24.1 tptt 41.66 19.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.732 -0.605 . . . . 0.0 110.647 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.537 ' N ' ' O ' ' A' ' 54' ' ' VAL . 28.3 ttmt -75.65 151.37 37.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.826 -1.171 . . . . 0.0 107.939 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.46 ' OD1' ' N ' ' A' ' 57' ' ' ASP . 0.7 OUTLIER -53.59 89.78 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.405 -0.809 . . . . 0.0 108.925 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.528 ' N ' ' O ' ' A' ' 56' ' ' LYS . 10.7 m0 -78.3 -43.47 27.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.514 ' C ' ' H ' ' A' ' 61' ' ' HIS . 32.2 t -54.2 -48.69 70.72 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.609 -0.682 . . . . 0.0 109.249 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -59.59 -1.41 0.24 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.387 -0.82 . . . . 0.0 109.16 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.546 ' NE2' ' CB ' ' A' ' 26' ' ' ASP . 14.9 m80 -123.18 147.93 46.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.619 -0.676 . . . . 0.0 109.477 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.532 ' H ' ' C ' ' A' ' 93' ' ' THR . . . -156.38 179.35 9.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.384 -0.822 . . . . 0.0 108.828 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.721 HD22 ' N ' ' A' ' 63' ' ' LEU . 2.9 mm? -94.92 140.43 29.95 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.02 -1.05 . . . . 0.0 110.502 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.516 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -134.67 146.6 49.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.5 t90 -105.82 91.34 3.7 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.938 -1.101 . . . . 0.0 108.751 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 9.7 pt-20 -55.92 -22.52 26.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.968 . . . . 0.0 110.811 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -64.9 -18.09 64.9 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 178.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -125.45 -11.37 6.84 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.303 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.2 mpp_? 53.34 47.38 24.34 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 -178.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -115.14 -170.75 1.82 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.45 0.643 . . . . 0.0 110.033 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -124.28 99.83 6.41 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 177.081 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.0 86.5 0.01 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.676 -1.265 . . . . 0.0 110.895 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.1 pp -121.35 4.33 10.26 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.514 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -69.82 35.09 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.062 -1.024 . . . . 0.0 109.306 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.554 HG23 ' H ' ' A' ' 42' ' ' GLY . 21.8 m -51.73 -7.18 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.684 -1.26 . . . . 0.0 109.849 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.514 ' H ' ' C ' ' A' ' 74' ' ' LYS . 1.1 t60 -50.31 -73.14 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.183 -0.948 . . . . 0.0 110.2 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -90.64 -112.43 0.08 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.083 -1.011 . . . . 0.0 109.961 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -152.83 -163.39 1.7 Allowed 'General case' 0 N--CA 1.504 2.233 0 O-C-N 119.563 -1.961 . . . . 0.0 111.445 -178.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.597 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.8 mp -70.51 -57.27 4.94 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -42.68 -45.68 4.79 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.127 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.511 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -83.18 -47.94 11.04 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.38 7.17 12.56 Favored Glycine 0 N--CA 1.501 3.012 0 N-CA-C 108.547 -1.821 . . . . 0.0 108.547 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.515 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 36.9 mt -61.15 160.49 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -154.15 -164.42 1.85 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 108.986 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -75.25 -17.28 60.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.348 -0.845 . . . . 0.0 109.772 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.06 3.85 50.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.492 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.02 113.34 25.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.284 -0.885 . . . . 0.0 108.981 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -96.03 123.63 39.72 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.001 -1.062 . . . . 0.0 109.994 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.474 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.6 mt -106.46 177.94 4.71 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.771 0.795 . . . . 0.0 109.123 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.516 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 6.0 mt-30 -131.87 165.36 24.04 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -117.05 91.34 3.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.532 ' C ' ' H ' ' A' ' 62' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.67 135.58 57.68 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 120.949 -1.094 . . . . 0.0 110.259 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.517 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.38 103.5 12.79 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.41 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.3 t -50.22 126.1 13.99 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-O 122.153 0.978 . . . . 0.0 109.628 -177.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.17 5.6 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 106.304 -2.718 . . . . 0.0 106.304 -177.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.1 m -105.94 -35.82 7.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.462 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.0 mm-40 55.16 56.22 6.74 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 122.658 1.218 . . . . 0.0 110.004 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp -140.79 124.21 10.13 Favored Pre-proline 0 C--N 1.293 -1.853 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -44.38 136.05 8.69 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.447 1.195 . . . . 0.0 114.612 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.0 mt -95.37 98.26 7.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.6 p -100.11 90.72 4.47 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.259 -0.901 . . . . 0.0 111.169 -177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.01 -95.87 0.15 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.405 -2.278 . . . . 0.0 107.405 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.458 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.5 mmt180 -113.15 149.52 33.48 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.34 126.36 15.47 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.984 -1.073 . . . . 0.0 111.455 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . 0.519 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 48.9 mt -91.14 146.86 5.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.691 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.9 m -117.28 146.96 42.98 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.766 0.793 . . . . 0.0 109.131 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.67 -129.3 0.26 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.551 0.691 . . . . 0.0 109.401 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.55 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.2 mtt -65.78 26.26 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.2 -8.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 -178.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -81.42 164.45 22.06 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -106.94 174.5 5.86 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.88 137.57 8.72 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.104 -1.438 . . . . 0.0 110.005 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.603 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.3 m80 -57.11 116.01 12.23 Favored Pre-proline 0 C--N 1.3 -1.574 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 177.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.55 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.9 Cg_exo -43.9 -9.38 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.391 0 CA-C-N 120.129 1.082 . . . . 0.0 112.755 -178.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.915 ' O ' HG13 ' B' ' 574' ' ' VAL . 6.9 mt-10 -105.26 -52.85 2.76 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.197 -0.939 . . . . 0.0 110.037 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.508 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 13.3 m170 -55.79 -4.97 0.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.822 -1.174 . . . . 0.0 109.75 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.469 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.2 t80 -122.26 52.15 1.32 Allowed 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.915 HG13 ' O ' ' B' ' 571' ' ' GLU . 18.7 m -92.53 177.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.396 0 CA-C-O 121.58 0.705 . . . . 0.0 109.218 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.667 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.74 145.83 32.68 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.476 -0.765 . . . . 0.0 109.088 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . 0.464 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -93.55 77.16 4.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 117.019 -1.873 . . . . 0.0 108.809 178.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . 0.424 ' HE2' ' HG ' ' A' ' 59' ' ' SER . 85.4 t80 -151.28 -45.96 0.11 Allowed 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 101.802 -3.407 . . . . 0.0 101.802 174.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.8 OUTLIER -126.83 154.98 43.61 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 111.677 -2.511 . . . . 0.0 105.314 177.559 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 1.108 ' H ' HD22 ' B' ' 579' ' ' LEU . 0.0 OUTLIER -104.74 14.32 29.89 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.659 -1.276 . . . . 0.0 111.281 -178.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.557 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -100.28 -39.25 8.12 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-N 120.909 1.686 . . . . 0.0 115.502 -176.181 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.57 142.44 9.48 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 122.29 2.314 . . . . 0.0 115.846 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.667 HD13 ' HB2' ' B' ' 575' ' ' CYS . 24.2 tp -136.91 169.75 17.24 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 174.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.446 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.0 m-20 -147.32 129.66 15.73 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.992 -1.067 . . . . 0.0 109.299 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.691 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.0 ptpp? -51.17 -17.72 0.73 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.539 -0.726 . . . . 0.0 109.753 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.29 -20.81 51.28 Favored Glycine 0 N--CA 1.487 2.072 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.3 p -133.88 28.11 3.89 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.582 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.6 OUTLIER -89.64 106.98 18.82 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.736 1.255 . . . . 0.0 109.836 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.72 167.71 10.61 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 179.486 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -152.08 157.27 41.39 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 122.634 1.207 . . . . 0.0 110.721 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.546 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 2.1 tp60 -154.87 146.12 22.88 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.497 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.24 23.89 0.13 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.969 -1.082 . . . . 0.0 110.111 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.483 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.5 m-20 81.66 -4.9 1.57 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.598 -0.689 . . . . 0.0 110.809 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -89.15 121.69 69.33 Favored Pre-proline 0 C--N 1.294 -1.827 0 O-C-N 121.296 -0.878 . . . . 0.0 109.457 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.48 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.7 Cg_exo -48.71 164.82 0.2 Allowed 'Trans proline' 0 N--CA 1.489 1.227 0 CA-C-N 119.945 1.016 . . . . 0.0 111.809 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.2 m-85 -170.51 141.48 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.626 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . 0.507 ' HG ' ' CB ' ' B' ' 575' ' ' CYS . 20.6 m -76.16 155.74 34.32 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 104.455 -2.424 . . . . 0.0 104.455 174.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.585 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.77 -57.82 11.08 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 117.293 -1.763 . . . . 0.0 106.383 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.03 -29.09 1.34 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.503 -0.748 . . . . 0.0 109.359 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.8 m -80.89 -64.82 1.11 Allowed 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -53.35 -53.37 52.08 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.672 -0.642 . . . . 0.0 109.988 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.69 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -48.52 -42.34 32.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.092 -1.005 . . . . 0.0 108.776 -179.167 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 26.3 tptt -61.36 -20.4 62.95 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.38 -0.825 . . . . 0.0 110.26 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.623 HD13 HD12 ' A' ' 46' ' ' LEU . 7.7 mt -91.68 -56.29 3.16 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.69 -1.257 . . . . 0.0 110.409 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.546 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 3.8 m-85 -93.16 9.3 36.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.991 -1.068 . . . . 0.0 109.618 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.485 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 12.0 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.302 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.529 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.488 2.147 0 N-CA-C 107.558 -2.217 . . . . 0.0 107.558 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 p -75.66 121.92 23.2 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.006 0.908 . . . . 0.0 110.726 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -141.35 124.07 16.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 178.676 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.628 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.87 130.97 40.98 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.59 -1.319 . . . . 0.0 109.872 -179.173 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.478 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.55 130.68 34.71 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 179.107 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.78 146.15 33.95 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.331 -0.855 . . . . 0.0 109.818 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.515 HG21 ' CE2' ' A' ' 92' ' ' PHE . 25.1 t -132.4 156.82 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-O 122.388 1.09 . . . . 0.0 110.042 178.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.538 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 15.7 m80 -128.42 98.91 5.21 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 104.195 -2.521 . . . . 0.0 104.195 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.56 ' O ' ' N ' ' A' ' 28' ' ' ASN . 9.0 t -73.15 94.35 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 C-N-CA 119.026 -1.07 . . . . 0.0 109.149 -178.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.491 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -64.99 169.08 5.64 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.742 -1.206 . . . . 0.0 107.742 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 0.9 OUTLIER 73.01 -45.52 0.62 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 25' ' ' THR . 9.1 tp -92.15 -32.62 15.05 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.56 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 73.05 9.91 5.32 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.447 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.433 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 60.0 mtp180 -87.03 -179.79 6.54 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 120.53 -1.356 . . . . 0.0 108.947 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.538 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 1.0 OUTLIER -143.04 123.05 13.57 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.875 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.6 t -127.69 158.64 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 CA-C-O 121.415 0.626 . . . . 0.0 110.771 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -123.34 139.95 53.52 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 32' ' ' THR . 2.2 mm? -119.73 113.33 20.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.536 -0.727 . . . . 0.0 109.89 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -60.41 104.35 0.32 Allowed 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.5 m -129.17 -169.03 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 122.01 0.909 . . . . 0.0 110.566 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.1 p -143.39 166.32 25.09 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.486 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -76.84 48.08 2.61 Favored Glycine 0 N--CA 1.485 1.937 0 C-N-CA 119.133 -1.508 . . . . 0.0 109.572 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.435 ' C ' HG21 ' A' ' 78' ' ' THR . 1.1 pp20? -153.59 2.43 0.27 Allowed 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.641 -0.917 . . . . 0.0 109.172 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 m -81.33 139.62 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 120.892 -1.13 . . . . 0.0 109.187 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.45 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m80 -79.09 140.74 37.78 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.462 HD13 ' HB3' ' A' ' 72' ' ' LEU . 74.3 mt -46.9 -57.31 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.156 -0.965 . . . . 0.0 109.476 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.77 -10.26 8.15 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.399 -1.481 . . . . 0.0 109.399 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -80.69 -24.26 58.68 Favored Glycine 0 N--CA 1.481 1.671 0 N-CA-C 106.51 -2.636 . . . . 0.0 106.51 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 45' ' ' MET . 0.4 OUTLIER -73.48 -55.65 11.89 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 114.681 -0.759 . . . . 0.0 109.094 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.534 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 39.7 mtm -46.22 -32.04 2.81 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.26 -0.9 . . . . 0.0 108.942 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.436 HD12 HD13 ' B' ' 603' ' ' LEU . 3.2 tt -71.65 -28.9 64.07 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.12 -179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -88.82 -59.26 2.28 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.125 -1.609 . . . . 0.0 111.748 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.61 HD13 ' CZ ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -45.69 -55.78 6.03 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.762 -1.211 . . . . 0.0 109.001 -178.588 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 72.7 t -51.81 -50.82 31.06 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 C-N-CA 119.931 -0.708 . . . . 0.0 109.875 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -47.68 -41.13 21.81 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.914 -1.116 . . . . 0.0 109.566 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -68.11 -38.45 82.28 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.289 -0.882 . . . . 0.0 109.861 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.422 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -66.51 -69.44 0.3 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.17 -0.956 . . . . 0.0 108.829 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.422 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 7.7 t70 75.07 83.29 0.1 Allowed 'General case' 0 N--CA 1.488 1.438 0 CA-C-O 121.977 0.894 . . . . 0.0 109.977 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.519 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.0 p -168.77 150.89 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.977 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.63 27.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.524 -0.735 . . . . 0.0 109.448 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.519 ' H ' ' C ' ' A' ' 54' ' ' VAL . 9.0 ttpp -78.75 147.36 33.41 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.902 -1.124 . . . . 0.0 109.634 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -69.48 112.53 6.07 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.543 -0.723 . . . . 0.0 109.249 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.536 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 79.3 m95 -108.39 -42.78 4.49 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.462 -0.774 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.8 t -45.45 -55.09 6.51 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 109.643 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -51.03 -33.98 27.67 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.537 ' CG ' ' O ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -71.41 115.46 10.61 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 121.943 0.878 . . . . 0.0 109.261 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -121.15 164.28 17.13 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.878 HD22 ' H ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -93.87 141.16 28.83 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.882 -1.136 . . . . 0.0 110.97 -177.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.511 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.34 140.99 51.57 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -101.85 91.84 4.55 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 17.0 pt-20 -55.56 -21.99 19.69 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.122 -0.986 . . . . 0.0 111.005 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.488 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -65.62 -19.38 65.89 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 105.647 -1.982 . . . . 0.0 105.647 178.154 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -123.22 -12.66 7.84 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.441 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 53.9 45.36 27.91 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -177.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -112.64 -173.93 2.35 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.492 0.663 . . . . 0.0 110.032 -178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.33 5.59 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.462 ' HB3' HD13 ' A' ' 41' ' ' ILE . 15.8 mt -62.05 84.1 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.122 0 O-C-N 120.231 -1.543 . . . . 0.0 110.278 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -113.6 14.02 18.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.565 ' NZ ' ' CZ ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -85.48 66.44 9.68 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.807 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.61 HG21 ' O ' ' B' ' 602' ' ' LYS . 1.9 m -64.99 -6.7 9.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.0 109.776 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -84.43 -35.82 22.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.164 -0.96 . . . . 0.0 110.07 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.0 m95 -91.65 -160.25 0.71 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.115 -0.991 . . . . 0.0 109.505 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.658 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -150.01 169.18 21.81 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 122.086 0.946 . . . . 0.0 109.238 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.527 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 9.1 mp -43.65 -63.81 0.77 Allowed 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.994 0.902 . . . . 0.0 109.257 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -43.01 -51.37 5.71 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.875 0.845 . . . . 0.0 110.075 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.658 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -45.44 -53.92 8.09 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-O 121.617 0.723 . . . . 0.0 109.794 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.565 ' CZ ' ' NZ ' ' A' ' 74' ' ' LYS . 10.5 m-85 -77.33 -40.21 44.98 Favored 'General case' 0 C--N 1.298 -1.653 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.524 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.21 10.47 10.75 Favored Glycine 0 N--CA 1.5 2.952 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.535 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.4 mt -61.09 160.19 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 O-C-N 121.537 -0.978 . . . . 0.0 108.937 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.535 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.83 -167.13 0.47 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.364 -0.835 . . . . 0.0 109.359 -179.38 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.63 -23.79 66.22 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 110.169 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -78.51 -8.03 58.12 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.237 -0.914 . . . . 0.0 108.673 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.69 26.23 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.5 mmtp -93.17 119.92 32.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.992 -1.067 . . . . 0.0 109.067 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.7 mt -99.32 176.03 5.67 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 121.795 0.807 . . . . 0.0 110.5 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.511 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.1 mt-30 -133.63 147.44 51.47 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.677 ' CD2' HD12 ' A' ' 63' ' ' LEU . 4.2 m-85 -113.27 97.64 6.61 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.761 0 O-C-N 121.298 -0.876 . . . . 0.0 111.28 -177.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m . . . . . 0 N--CA 1.488 1.431 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.69 135.66 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.883 -1.135 . . . . 0.0 110.271 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.506 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.62 103.93 13.34 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 105.811 -1.922 . . . . 0.0 105.811 178.2 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.7 t -50.62 126.79 16.41 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.124 0.964 . . . . 0.0 109.727 -177.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.92 5.17 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 106.208 -2.757 . . . . 0.0 106.208 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.34 -35.85 7.39 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.452 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.3 mm-40 55.68 56.4 6.2 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 122.656 1.217 . . . . 0.0 110.138 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -140.49 123.45 10.03 Favored Pre-proline 0 C--N 1.293 -1.865 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -44.29 134.99 8.9 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 120.534 1.227 . . . . 0.0 114.485 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.5 mt -93.92 98.2 7.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 24.7 p -100.07 91.13 4.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.228 -0.92 . . . . 0.0 111.333 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.17 -97.07 0.16 Allowed Glycine 0 N--CA 1.486 2.028 0 N-CA-C 107.063 -2.415 . . . . 0.0 107.063 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.464 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 0.9 OUTLIER -111.94 150.64 30.23 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 177.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.32 125.78 14.89 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.227 1.013 . . . . 0.0 111.411 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . 0.608 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 47.0 mt -91.09 147.41 5.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.691 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 8.7 m -118.14 146.93 43.8 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 121.786 0.803 . . . . 0.0 109.072 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.725 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.22 -129.14 0.26 Allowed 'General case' 0 C--N 1.295 -1.768 0 CA-C-O 121.593 0.711 . . . . 0.0 109.359 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.6 mtt -65.65 26.28 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.725 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.21 -9.16 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -178.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -82.28 162.17 22.38 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -103.9 174.31 5.93 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -159.75 138.55 10.75 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 118.211 -1.395 . . . . 0.0 109.861 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.605 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.6 m80 -57.89 116.99 16.22 Favored Pre-proline 0 C--N 1.299 -1.63 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.545 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 53.1 Cg_exo -45.38 -9.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.403 0 CA-C-N 120.33 1.154 . . . . 0.0 111.793 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.921 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.9 mt-10 -100.02 -52.33 3.45 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.155 0.979 . . . . 0.0 109.977 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.445 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 22.0 m170 -58.21 -3.35 0.25 Allowed 'General case' 0 C--N 1.293 -1.884 0 O-C-N 120.696 -1.252 . . . . 0.0 109.9 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 31.2 t80 -127.68 57.53 1.52 Allowed 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.921 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.48 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.717 0.77 . . . . 0.0 111.403 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.619 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.86 146.12 35.86 Favored 'General case' 0 N--CA 1.504 2.266 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.36 74.69 3.33 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 116.623 -2.031 . . . . 0.0 109.974 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -63.66 0.14 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 101.962 -3.347 . . . . 0.0 101.962 172.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.2 p -114.22 80.42 1.39 Allowed 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 112.356 -2.202 . . . . 0.0 105.108 176.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.2 16.99 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 -176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.05 -36.23 17.08 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 119.687 -1.883 . . . . 0.0 112.691 -178.606 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.545 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.6 tp60 -159.47 139.59 11.9 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 119.295 -2.128 . . . . 0.0 115.138 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.619 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.2 tp -141.33 168.83 18.85 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.43 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 63.9 m-20 -148.25 140.24 23.99 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -0.965 . . . . 0.0 109.092 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.691 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.6 ptpp? -57.6 -19.65 27.35 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.394 -0.816 . . . . 0.0 109.636 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.3 -17.22 57.72 Favored Glycine 0 N--CA 1.485 1.96 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.11 25.35 4.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.943 -0.739 . . . . 0.0 109.422 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.519 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.12 114.45 26.39 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-O 122.283 1.04 . . . . 0.0 109.408 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -106.16 167.1 10.04 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 179.074 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.7 tt0 -153.48 157.54 40.0 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.618 -1.301 . . . . 0.0 111.323 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.54 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.2 tp-100 -156.81 146.21 20.5 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 178.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.589 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 47.07 23.55 0.3 Allowed 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.939 -1.101 . . . . 0.0 109.609 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.9 m-20 81.51 -6.0 1.54 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.759 -0.588 . . . . 0.0 110.973 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -88.17 118.1 69.17 Favored Pre-proline 0 C--N 1.295 -1.789 0 O-C-N 121.16 -0.963 . . . . 0.0 110.005 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.542 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.1 Cg_exo -49.87 164.45 0.4 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 CA-C-N 119.988 1.031 . . . . 0.0 111.855 179.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.542 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.73 137.98 1.36 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.276 -0.89 . . . . 0.0 109.877 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.06 156.6 35.66 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.555 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.61 -56.4 20.24 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 178.526 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.46 -28.63 0.94 Allowed 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 21.1 m -84.14 -65.88 0.96 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.449 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.7 OUTLIER -45.6 -52.29 10.83 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.594 0.712 . . . . 0.0 109.583 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.64 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -59.9 -40.95 90.51 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.574 -0.704 . . . . 0.0 109.393 -178.489 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.61 ' O ' HG21 ' A' ' 75' ' ' THR . 17.4 tptm -57.46 -26.27 60.97 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.157 -0.965 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.518 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -93.73 -56.66 2.82 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.028 -1.045 . . . . 0.0 111.123 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.5 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 0.3 OUTLIER -100.5 -29.62 12.26 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.178 -0.951 . . . . 0.0 110.727 -178.112 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.439 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 2.4 t . . . . . 0 N--CA 1.501 2.102 0 O-C-N 121.048 -1.033 . . . . 0.0 109.682 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.699 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -90.19 122.53 33.21 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.454 -1.027 . . . . 0.0 109.544 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.65 121.44 32.15 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.606 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.7 128.73 35.82 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.073 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.484 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -83.45 135.03 34.83 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.246 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.07 145.85 35.58 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.399 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.7 t -137.81 111.07 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 CA-C-O 121.923 0.868 . . . . 0.0 109.756 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.514 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 6.9 m-70 -85.8 103.59 14.71 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.1 t -73.03 82.8 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 O-C-N 121.159 -0.963 . . . . 0.0 109.192 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.62 166.4 0.93 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.77 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.5 t0 73.48 -46.3 0.63 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.575 HD12 ' HD2' ' A' ' 29' ' ' ARG . 0.3 OUTLIER -85.76 -36.34 20.2 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.345 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 75.72 13.28 2.91 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.339 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.575 ' HD2' HD12 ' A' ' 27' ' ' LEU . 43.5 mtp180 -90.41 -177.81 5.18 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.12 -0.988 . . . . 0.0 109.144 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.514 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 18.1 m-20 -144.45 116.87 8.54 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 32' ' ' THR . 19.9 t -119.41 157.4 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.693 0.759 . . . . 0.0 110.062 -178.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.424 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.12 133.01 42.34 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.424 HD22 ' C ' ' A' ' 32' ' ' THR . 2.7 mm? -113.84 113.24 24.63 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.705 -0.622 . . . . 0.0 109.334 -179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -59.95 105.95 0.45 Allowed 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' HG11 ' A' ' 39' ' ' VAL . 18.1 m -134.25 -169.51 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-O 121.988 0.899 . . . . 0.0 110.4 -178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.3 p -142.5 174.64 10.45 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.09 44.65 2.65 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.452 ' C ' HG21 ' A' ' 78' ' ' THR . 0.0 OUTLIER -145.58 4.07 1.01 Allowed 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.602 -0.94 . . . . 0.0 108.956 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.597 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -88.9 137.72 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.073 -1.017 . . . . 0.0 110.193 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.482 ' O ' ' N ' ' A' ' 43' ' ' GLY . 3.8 m-70 -79.25 144.38 34.39 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.138 -0.976 . . . . 0.0 108.912 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 87.9 mt -45.74 -58.54 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.257 -0.902 . . . . 0.0 110.175 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.07 -13.58 4.93 Favored Glycine 0 C--N 1.296 -1.677 0 N-CA-C 108.734 -1.746 . . . . 0.0 108.734 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.95 -26.33 58.47 Favored Glycine 0 N--CA 1.48 1.621 0 N-CA-C 108.54 -1.824 . . . . 0.0 108.54 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -83.32 -53.95 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.469 -1.018 . . . . 0.0 110.642 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -27.68 44.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.222 -1.549 . . . . 0.0 108.862 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -64.13 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -52.28 -53.99 37.07 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.431 -0.793 . . . . 0.0 110.17 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.5 tp -44.93 -51.52 9.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.508 -0.745 . . . . 0.0 110.098 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.81 -47.13 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.815 -1.178 . . . . 0.0 109.008 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -48.03 -40.62 23.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.275 -0.891 . . . . 0.0 109.474 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -69.21 -43.87 73.23 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.406 -0.809 . . . . 0.0 110.011 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -48.96 -58.1 5.43 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.566 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.4 t70 74.0 75.47 0.12 Allowed 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.938 0.875 . . . . 0.0 110.135 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.493 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -175.16 132.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.292 -1.905 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.593 ' HB3' HD21 ' B' ' 579' ' ' LEU . 7.1 mmtt -69.46 35.86 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.458 -0.776 . . . . 0.0 109.381 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.539 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 39.4 tttp -78.95 135.42 36.94 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.628 -1.295 . . . . 0.0 108.681 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.406 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 14.3 t70 -50.02 119.72 3.83 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.223 -0.923 . . . . 0.0 108.958 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 55.1 m95 -120.23 -35.93 3.34 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.58 -0.7 . . . . 0.0 110.539 -179.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 58' ' ' TRP . 8.2 t -43.15 -50.27 6.28 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.293 -0.879 . . . . 0.0 109.164 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -55.52 -43.06 75.38 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.603 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.4 OUTLIER -71.16 115.15 9.97 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.582 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -129.56 168.99 15.58 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.624 ' O ' HD12 ' A' ' 63' ' ' LEU . 0.3 OUTLIER -95.71 149.37 21.55 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 122.289 1.042 . . . . 0.0 110.679 -178.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.623 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -141.6 142.87 33.46 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 -178.71 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.696 ' HB2' HD21 ' A' ' 72' ' ' LEU . 5.1 t90 -94.96 90.8 6.1 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.292 -1.505 . . . . 0.0 108.955 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.416 ' C ' ' N ' ' A' ' 68' ' ' LYS . 14.3 pt-20 -55.44 -23.46 25.41 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.069 -1.019 . . . . 0.0 110.585 -179.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.483 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 12.6 mmtp -66.53 -10.4 44.57 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.416 ' N ' ' C ' ' A' ' 66' ' ' GLU . 17.7 mmtt -133.29 -11.08 2.87 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.616 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.3 mpp_? 52.73 47.18 25.24 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 4.0 t -115.43 -172.15 2.09 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.472 0.653 . . . . 0.0 109.834 -178.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.56 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.8 99.21 5.04 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 177.02 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.696 HD21 ' HB2' ' A' ' 65' ' ' TRP . 0.5 OUTLIER -62.38 87.72 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.182 0 O-C-N 120.667 -1.271 . . . . 0.0 108.832 -176.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 13.01 12.55 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.96 74.72 9.67 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -25.22 68.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.909 -1.12 . . . . 0.0 108.354 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.48 ' O ' ' CE3' ' A' ' 77' ' ' TRP . 2.8 t60 -82.83 73.71 9.84 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.48 ' CE3' ' O ' ' A' ' 76' ' ' HIS . 0.1 OUTLIER 161.04 -167.77 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 -179.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.68 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -149.44 -172.0 4.03 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.776 -1.202 . . . . 0.0 109.432 -179.756 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -62.49 -58.82 6.24 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -42.95 -50.98 5.77 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.695 0.76 . . . . 0.0 109.874 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.68 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -46.54 -54.39 9.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-O 121.58 0.705 . . . . 0.0 109.684 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -73.71 -41.11 63.04 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.117 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 114.11 8.8 16.83 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 108.131 -1.988 . . . . 0.0 108.131 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 58.9 mt -61.07 157.94 2.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.755 -0.85 . . . . 0.0 109.135 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.16 -165.78 1.04 Allowed 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.61 -24.85 63.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.468 -0.77 . . . . 0.0 110.022 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.4 p30 -78.6 -7.98 58.15 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 108.769 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.61 26.12 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.0 mmtp -93.82 116.02 28.46 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.982 -1.074 . . . . 0.0 110.018 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.484 ' HG ' HD12 ' A' ' 20' ' ' LEU . 12.2 mt -91.16 176.65 6.51 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 178.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.623 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.9 mt-30 -135.6 171.73 14.03 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.54 97.62 3.19 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.417 ' CB ' ' OG1' ' A' ' 25' ' ' THR . 3.0 t . . . . . 0 N--CA 1.491 1.582 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.85 -177.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.531 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.0 m . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.86 136.39 57.96 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.407 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.489 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.61 103.9 13.3 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.245 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -51.1 126.96 17.83 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.198 0.999 . . . . 0.0 109.641 -177.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -34.56 5.42 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.172 -2.771 . . . . 0.0 106.172 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.73 -35.47 7.36 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 178.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.457 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.3 mm-40 55.08 56.22 6.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 122.742 1.258 . . . . 0.0 110.025 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -141.02 125.02 10.31 Favored Pre-proline 0 C--N 1.293 -1.856 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -44.24 137.65 7.5 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 120.372 1.169 . . . . 0.0 114.993 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.531 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.8 mt -96.58 98.72 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.007 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 71.8 p -99.84 93.41 5.78 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.234 -0.916 . . . . 0.0 111.356 -177.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 153.25 -95.4 0.15 Allowed Glycine 0 N--CA 1.487 2.082 0 N-CA-C 107.406 -2.278 . . . . 0.0 107.406 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.477 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.29 152.48 31.3 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.1 p -144.48 126.19 15.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.012 -1.055 . . . . 0.0 111.265 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.8 mt -90.6 146.5 6.12 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.78 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.8 m -118.51 146.74 44.3 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 121.888 0.852 . . . . 0.0 109.049 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.85 -129.0 0.25 Allowed 'General case' 0 C--N 1.295 -1.79 0 CA-C-O 121.607 0.718 . . . . 0.0 109.407 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 14.1 mtp -65.57 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.02 -8.75 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -178.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -81.84 159.93 23.62 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt -102.91 174.47 5.86 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.69 136.18 8.01 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.231 -1.388 . . . . 0.0 109.957 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.588 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.79 115.81 10.52 Favored Pre-proline 0 C--N 1.3 -1.567 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 177.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.7 Cg_exo -46.22 -8.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.452 0 CA-C-N 120.353 1.162 . . . . 0.0 111.814 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.921 ' O ' HG13 ' B' ' 574' ' ' VAL . 12.2 mt-10 -100.64 -52.84 3.23 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.021 0.915 . . . . 0.0 110.06 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.523 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.2 m170 -57.03 -4.7 0.19 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.848 -1.157 . . . . 0.0 109.863 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.457 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.6 t80 -124.77 54.53 1.4 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 178.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.921 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -93.74 177.6 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.827 0.823 . . . . 0.0 110.738 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.588 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -76.9 149.33 36.07 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -96.35 76.07 2.95 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 116.787 -1.965 . . . . 0.0 110.736 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.84 -56.97 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 172.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.8 p -117.21 121.99 42.74 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 112.535 -2.121 . . . . 0.0 106.772 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 55' ' ' LYS . 10.8 mp -75.01 14.19 0.56 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 121.05 -1.031 . . . . 0.0 111.981 -177.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -92.27 -39.5 11.48 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 119.361 -2.087 . . . . 0.0 115.277 -175.802 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -162.72 141.57 8.79 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 122.513 2.415 . . . . 0.0 116.332 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.7 tp -142.04 168.69 19.15 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 174.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.504 ' O ' ' N ' ' B' ' 587' ' ' PHE . 72.2 m-20 -149.82 135.86 18.76 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.917 -1.114 . . . . 0.0 109.048 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.78 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 1.2 ptpp? -54.87 -14.37 1.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.21 -0.931 . . . . 0.0 109.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . 0.408 ' N ' ' C ' ' B' ' 583' ' ' ASN . . . -94.72 -15.5 45.93 Favored Glycine 0 N--CA 1.486 2.019 0 N-CA-C 108.735 -1.746 . . . . 0.0 108.735 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.1 p -136.72 26.17 3.07 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.907 -0.76 . . . . 0.0 108.983 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 2.2 p90 -89.25 108.18 19.47 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 122.446 1.117 . . . . 0.0 109.338 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.56 165.63 11.53 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.429 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -153.2 157.29 40.02 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 122.656 1.217 . . . . 0.0 110.718 -178.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.507 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -156.56 145.96 20.62 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.592 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 46.79 23.58 0.27 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.037 -1.039 . . . . 0.0 109.497 -179.642 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.48 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 82.55 -7.19 1.29 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.818 -0.551 . . . . 0.0 110.865 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -87.83 116.45 66.2 Favored Pre-proline 0 C--N 1.295 -1.763 0 O-C-N 121.123 -0.986 . . . . 0.0 110.067 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.3 Cg_exo -50.26 164.34 0.49 Allowed 'Trans proline' 0 N--CA 1.488 1.176 0 CA-C-N 120.026 1.045 . . . . 0.0 111.698 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 24.2 m-85 -170.4 140.5 1.83 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.259 -0.901 . . . . 0.0 109.837 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.7 m -69.63 154.72 41.59 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 175.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.539 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.7 -56.97 15.34 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 178.481 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.31 -30.04 1.9 Allowed 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 6.6 m -81.24 -63.14 1.46 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.554 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.48 -54.34 28.07 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.437 0.637 . . . . 0.0 110.375 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.692 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -52.78 -41.8 64.44 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.375 -0.828 . . . . 0.0 109.902 -178.07 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.83 -23.22 66.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.031 -1.043 . . . . 0.0 110.719 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.453 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.3 OUTLIER -91.86 -56.3 3.14 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.571 -1.331 . . . . 0.0 111.915 -177.09 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.449 ' C ' ' SG ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -103.7 4.77 35.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.185 -0.947 . . . . 0.0 111.155 -177.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.449 ' SG ' ' C ' ' B' ' 604' ' ' PHE . 2.1 m . . . . . 0 N--CA 1.498 1.95 0 O-C-N 120.714 -1.241 . . . . 0.0 109.445 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.838 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.541 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.1 OUTLIER -98.61 126.84 44.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.383 -1.069 . . . . 0.0 109.839 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.5 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.5 OUTLIER -128.58 123.86 34.46 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.296 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.83 137.75 39.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.903 . . . . 0.0 109.561 -179.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.23 129.17 34.86 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.06 143.29 37.55 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.882 -1.136 . . . . 0.0 108.353 179.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.47 153.24 30.61 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-O 121.65 0.738 . . . . 0.0 109.415 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.464 ' H ' ' HA ' ' A' ' 91' ' ' GLN . 24.5 m80 -123.26 102.16 7.78 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.005 -1.479 . . . . 0.0 107.005 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.96 102.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.503 ' C ' ' H ' ' A' ' 27' ' ' LEU . 53.9 p -75.72 -35.39 60.26 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.34 -0.85 . . . . 0.0 109.675 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -76.01 19.05 0.24 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.181 -0.95 . . . . 0.0 108.496 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.503 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -154.74 -28.51 0.11 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.627 -0.671 . . . . 0.0 109.203 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.2 OUTLIER 82.97 12.64 0.46 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 122.135 -0.353 . . . . 0.0 110.199 -179.534 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -95.27 -178.32 4.41 Favored 'General case' 0 C--N 1.309 -1.181 0 O-C-N 120.85 -1.157 . . . . 0.0 109.881 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.421 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 1.3 m-20 -138.44 121.04 16.22 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.7 t -119.46 154.58 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.788 0.804 . . . . 0.0 110.577 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -130.8 128.89 41.62 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.811 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 32' ' ' THR . 3.0 mm? -115.1 115.31 26.58 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.39 0.614 . . . . 0.0 110.034 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.541 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.7 tpt180 -59.62 112.29 1.74 Allowed 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -140.73 -171.21 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.983 0.897 . . . . 0.0 110.461 -179.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 p -144.43 176.22 9.54 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.85 44.57 3.14 Favored Glycine 0 N--CA 1.481 1.681 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.502 ' C ' HG21 ' A' ' 78' ' ' THR . 3.4 pt-20 -145.61 1.68 0.92 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.589 -0.948 . . . . 0.0 108.881 178.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.457 ' O ' HG22 ' A' ' 78' ' ' THR . 1.4 m -89.14 134.0 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.939 -1.101 . . . . 0.0 109.547 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.46 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.8 m-70 -73.45 147.37 44.22 Favored 'General case' 0 C--N 1.29 -2.001 0 O-C-N 120.948 -1.095 . . . . 0.0 108.175 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.434 ' C ' ' N ' ' A' ' 43' ' ' GLY . 81.6 mt -48.75 -51.39 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 120.998 -1.064 . . . . 0.0 108.947 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.52 -10.87 6.42 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 108.482 -1.847 . . . . 0.0 108.482 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -74.93 -26.82 65.88 Favored Glycine 0 N--CA 1.483 1.773 0 N-CA-C 107.919 -2.073 . . . . 0.0 107.919 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 45' ' ' MET . 2.1 t -84.13 -42.95 17.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.404 ' C ' ' O ' ' A' ' 44' ' ' VAL . 40.9 mtm -45.51 -36.25 4.4 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.26 -65.81 0.73 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 121.398 0.618 . . . . 0.0 110.095 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 48.2 mttm -52.88 -55.67 21.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.446 -0.783 . . . . 0.0 111.275 -178.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -45.05 -56.69 4.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.946 -1.097 . . . . 0.0 109.759 -178.524 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.5 t -60.64 -47.36 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.04 -1.037 . . . . 0.0 110.117 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -45.06 -39.63 5.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.153 -0.967 . . . . 0.0 109.85 -179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -65.52 -57.06 9.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.318 -0.864 . . . . 0.0 110.392 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -67.17 0.45 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t0 62.62 89.03 0.09 Allowed 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.863 0.839 . . . . 0.0 109.242 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.704 ' O ' HG22 ' A' ' 54' ' ' VAL . 1.6 p -155.67 33.13 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.303 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 tptt 41.23 17.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.778 -0.576 . . . . 0.0 110.649 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.576 ' N ' ' O ' ' A' ' 54' ' ' VAL . 16.7 ttmm -78.7 146.72 33.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.967 -1.083 . . . . 0.0 109.027 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.53 115.09 2.12 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.509 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 60.4 m95 -117.72 -33.66 4.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.609 -0.682 . . . . 0.0 109.905 -179.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.5 t -42.99 -55.78 3.62 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.433 -0.792 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -50.99 -43.65 60.76 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.211 -0.93 . . . . 0.0 108.521 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -72.45 134.17 45.21 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.732 0.777 . . . . 0.0 110.214 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.86 -179.31 6.51 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.833 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -95.12 137.73 33.77 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.812 -1.18 . . . . 0.0 110.682 -179.384 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.498 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -125.88 148.97 49.03 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.555 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -105.13 92.08 4.07 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.711 -1.243 . . . . 0.0 108.708 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -54.31 -23.57 15.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.255 -0.903 . . . . 0.0 110.734 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.514 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 23.7 mmtp -67.82 -10.56 53.95 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -134.0 -11.43 2.6 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.132 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.555 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.63 45.84 27.86 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -111.93 -171.05 1.77 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.322 0.582 . . . . 0.0 109.804 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.551 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.56 99.68 5.46 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 177.608 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.41 ' HB3' HD13 ' A' ' 41' ' ' ILE . 36.1 mt -60.07 88.47 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.69 1.233 . . . . 0.0 110.634 -176.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.476 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.0 pp -123.04 13.04 9.71 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 178.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' A' ' 76' ' ' HIS . 10.1 mmpt? -75.37 43.18 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.735 -0.603 . . . . 0.0 109.966 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.686 HG21 ' O ' ' B' ' 602' ' ' LYS . 3.7 m -54.75 -6.37 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.982 -1.074 . . . . 0.0 109.58 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.48 ' H ' ' C ' ' A' ' 74' ' ' LYS . 87.2 m-70 -55.97 -68.57 0.19 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.252 -0.905 . . . . 0.0 110.861 -179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -99.05 -115.86 0.15 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.137 -0.977 . . . . 0.0 110.636 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.502 HG21 ' C ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -153.41 155.44 36.37 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.2 pt? -43.8 -51.1 7.58 Favored 'General case' 0 C--N 1.295 -1.78 0 O-C-N 121.275 -0.89 . . . . 0.0 110.654 179.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.438 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 17.6 t70 -45.49 -32.25 2.13 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.213 -0.929 . . . . 0.0 109.852 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.554 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -72.55 -32.01 65.72 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 -179.623 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.554 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.5 OUTLIER -73.33 -49.55 26.79 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 124.28 4.55 7.64 Favored Glycine 0 N--CA 1.51 3.619 0 N-CA-C 108.65 -1.78 . . . . 0.0 108.65 179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.9 mt -60.08 162.29 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -156.22 -164.64 1.73 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.048 -1.033 . . . . 0.0 108.741 178.697 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -73.57 -21.27 60.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.175 -0.953 . . . . 0.0 109.833 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.1 3.24 43.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.335 -0.853 . . . . 0.0 109.402 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.98 113.61 25.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.355 -0.841 . . . . 0.0 109.315 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -97.39 125.77 42.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.059 -1.026 . . . . 0.0 109.228 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.6 mt -112.7 178.61 4.23 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.714 0.769 . . . . 0.0 109.388 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.498 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.2 mt-30 -129.9 168.19 17.01 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -123.73 90.88 3.35 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.5 2.061 0 O-C-N 121.737 -0.602 . . . . 0.0 110.332 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.543 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.1 m . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.18 137.13 58.24 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.23 -0.919 . . . . 0.0 110.653 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.55 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.86 103.84 13.46 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 178.197 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.5 t -49.62 125.99 12.66 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.086 0.946 . . . . 0.0 109.624 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.33 -34.95 5.2 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 106.444 -2.663 . . . . 0.0 106.444 -177.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.17 -35.29 7.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.457 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.6 mm-40 55.01 56.27 6.77 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 122.694 1.235 . . . . 0.0 109.899 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt -140.83 124.7 10.34 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -43.7 138.29 5.8 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 CA-C-N 120.428 1.189 . . . . 0.0 114.83 -178.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.55 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.6 mt -97.61 98.69 7.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 51.8 p -100.06 91.35 4.74 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 121.955 0.883 . . . . 0.0 111.234 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.41 -96.66 0.16 Allowed Glycine 0 N--CA 1.488 2.102 0 N-CA-C 107.349 -2.3 . . . . 0.0 107.349 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.484 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 6.0 mmt-85 -113.08 153.02 28.84 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.5 p -144.83 126.47 15.13 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.022 -1.049 . . . . 0.0 111.425 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.4 mt -90.61 146.15 6.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 10.9 m -121.5 146.61 46.75 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.0 0.905 . . . . 0.0 109.151 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.738 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -128.92 0.26 Allowed 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.9 mtp -65.75 25.88 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.738 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.0 -8.56 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.84 149.07 28.5 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.5 mmmt -96.02 174.72 6.78 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.43 134.67 7.3 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.436 -1.306 . . . . 0.0 109.939 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.581 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.2 m80 -55.42 114.8 7.87 Favored Pre-proline 0 C--N 1.303 -1.428 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 177.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.577 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.1 Cg_exo -45.67 -10.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 CA-C-N 120.306 1.145 . . . . 0.0 111.964 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.745 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.9 mt-10 -100.64 -53.01 3.19 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 122.052 0.93 . . . . 0.0 110.067 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.56 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.7 m170 -55.41 -5.92 0.15 Allowed 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.589 -1.319 . . . . 0.0 109.839 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.471 ' H ' ' C ' ' B' ' 571' ' ' GLU . 21.2 t80 -124.27 52.53 1.49 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.745 HG13 ' O ' ' B' ' 571' ' ' GLU . 11.4 m -93.47 176.89 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 CA-C-O 121.514 0.673 . . . . 0.0 110.125 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.549 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.44 144.03 38.12 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 107.597 -1.261 . . . . 0.0 107.597 179.029 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -90.89 74.09 6.49 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 116.258 -2.177 . . . . 0.0 109.488 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -153.99 -65.85 0.14 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 172.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.536 ' O ' ' N ' ' B' ' 580' ' ' LYS . 17.0 p -110.67 84.03 1.86 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 112.514 -2.13 . . . . 0.0 105.616 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 0.857 HD22 ' N ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.49 15.1 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.67 -38.7 15.64 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 119.542 -1.973 . . . . 0.0 112.542 -178.267 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.577 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.25 142.16 9.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 119.5 -2.0 . . . . 0.0 115.02 178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.549 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.7 tp -136.7 170.1 16.63 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 175.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.502 ' O ' ' N ' ' B' ' 587' ' ' PHE . 77.2 m-20 -145.2 129.26 17.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.066 -1.022 . . . . 0.0 109.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -50.84 -22.64 2.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.522 -0.736 . . . . 0.0 109.651 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.12 -18.1 59.89 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.004 -1.638 . . . . 0.0 109.004 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.9 p -133.12 26.31 4.22 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.568 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.3 OUTLIER -89.48 108.53 19.7 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.579 1.18 . . . . 0.0 109.974 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.44 168.4 10.01 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.411 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.46 157.15 40.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.747 -1.221 . . . . 0.0 110.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.532 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.6 tp60 -150.84 144.2 24.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.553 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 41.98 27.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.217 -0.927 . . . . 0.0 110.452 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 3.6 m-20 84.26 -8.37 0.98 Allowed 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.758 -0.588 . . . . 0.0 111.05 179.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 53.2 mttt -88.18 116.78 67.26 Favored Pre-proline 0 C--N 1.296 -1.732 0 O-C-N 121.162 -0.961 . . . . 0.0 109.973 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.2 Cg_exo -50.2 163.93 0.54 Allowed 'Trans proline' 0 N--CA 1.492 1.434 0 CA-C-N 119.887 0.995 . . . . 0.0 112.576 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.526 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 21.6 m-85 -170.84 139.65 1.51 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.404 -0.81 . . . . 0.0 109.589 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 10.0 m -68.5 157.23 36.4 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 175.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.57 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.2 -55.58 32.05 Favored 'General case' 0 C--N 1.294 -1.836 0 C-N-CA 117.253 -1.779 . . . . 0.0 106.56 179.203 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.5 -31.28 2.64 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.331 -0.856 . . . . 0.0 109.182 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.28 -56.52 4.15 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.456 ' CD2' ' OE1' ' B' ' 590' ' ' GLN . 2.4 t80 -60.32 -53.53 56.56 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.443 0.64 . . . . 0.0 110.498 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.654 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.45 -43.34 62.06 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.117 -0.989 . . . . 0.0 109.431 -178.348 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.686 ' O ' HG21 ' A' ' 75' ' ' THR . 0.5 OUTLIER -58.82 -20.43 50.36 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.994 -1.066 . . . . 0.0 110.163 -179.208 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.409 ' N ' HD23 ' B' ' 603' ' ' LEU . 1.2 mt -91.98 -56.93 2.89 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.651 -1.28 . . . . 0.0 110.331 -178.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' C ' ' B' ' 605' ' ' CYS . 24.5 m-85 -106.41 32.36 4.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.508 -0.745 . . . . 0.0 109.935 -179.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' B' ' 604' ' ' PHE . 3.9 t . . . . . 0 N--CA 1.502 2.145 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.759 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.534 ' OG1' ' N ' ' A' ' 18' ' ' TRP . 2.7 t -167.85 178.46 5.2 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 117.548 -1.661 . . . . 0.0 111.693 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.534 ' N ' ' OG1' ' A' ' 17' ' ' THR . 0.5 OUTLIER -165.48 127.87 2.09 Favored 'General case' 0 C--N 1.277 -2.552 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.673 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -83.78 132.21 34.85 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.961 -1.087 . . . . 0.0 109.521 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.488 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.86 133.51 34.73 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.174 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.15 145.73 35.49 Favored 'General case' 0 C--N 1.295 -1.797 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.176 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -137.35 114.11 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.7 0.762 . . . . 0.0 110.015 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -85.76 103.77 14.84 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.526 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.63 107.01 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 27' ' ' LEU . 41.5 p -78.2 -41.08 35.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.327 -0.858 . . . . 0.0 110.037 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -73.02 20.53 0.08 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.055 -1.028 . . . . 0.0 108.793 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.7 mt -154.49 -33.0 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 85.23 14.09 0.19 Allowed 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 120.707 0.289 . . . . 0.0 110.429 -179.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.0 mtp-105 -95.58 -178.27 4.35 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 120.911 -1.118 . . . . 0.0 110.036 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -135.86 116.98 14.39 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.1 t -115.36 155.13 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.681 0.753 . . . . 0.0 110.004 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.46 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -134.37 131.59 38.45 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' O ' ' A' ' 32' ' ' THR . 2.1 mm? -118.54 115.91 25.57 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.53 ' O ' HG13 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -61.6 133.85 56.13 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.53 HG13 ' O ' ' A' ' 34' ' ' ARG . 13.9 m -160.7 -170.22 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.019 0 CA-C-O 122.071 0.938 . . . . 0.0 110.012 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.417 ' C ' ' H ' ' A' ' 38' ' ' GLU . 0.8 OUTLIER -142.13 171.16 14.43 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.047 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -77.58 45.04 2.33 Favored Glycine 0 C--N 1.293 -1.831 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.435 ' C ' HG21 ' A' ' 78' ' ' THR . 0.7 OUTLIER -144.99 3.49 1.06 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.765 -0.844 . . . . 0.0 108.926 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.577 ' O ' HG22 ' A' ' 78' ' ' THR . 2.6 m -90.1 135.69 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.041 -1.037 . . . . 0.0 110.076 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.445 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.8 OUTLIER -72.5 142.46 48.54 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 120.944 -1.098 . . . . 0.0 108.217 178.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.466 ' C ' ' N ' ' A' ' 43' ' ' GLY . 94.1 mt -47.8 -55.54 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.051 -1.031 . . . . 0.0 109.268 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.512 ' H ' HG23 ' A' ' 75' ' ' THR . . . -55.8 -8.9 2.32 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.531 -1.828 . . . . 0.0 108.531 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -75.12 -28.25 62.62 Favored Glycine 0 N--CA 1.484 1.869 0 N-CA-C 107.585 -2.206 . . . . 0.0 107.585 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.29 -40.88 16.53 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.475 ' O ' HG23 ' A' ' 49' ' ' VAL . 42.1 mtm -47.64 -35.02 8.73 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.57 -65.72 0.79 Allowed 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.745 -0.597 . . . . 0.0 109.954 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 53.5 mttm -49.39 -59.85 3.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.372 -0.83 . . . . 0.0 110.8 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.51 -55.56 6.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.016 -1.052 . . . . 0.0 109.39 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 45' ' ' MET . 70.0 t -56.5 -48.76 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -46.72 -40.71 13.87 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.053 -1.03 . . . . 0.0 109.591 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -76.6 -36.83 57.26 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.411 -0.805 . . . . 0.0 110.853 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.484 HD12 ' CG1' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -59.74 -65.01 0.75 Allowed 'General case' 0 C--N 1.305 -1.342 0 O-C-N 120.914 -1.116 . . . . 0.0 108.904 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 67.16 79.25 0.23 Allowed 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 121.822 0.82 . . . . 0.0 109.816 179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.562 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.7 p -171.03 146.06 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 C-N-CA 119.696 -0.802 . . . . 0.0 110.005 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.28 34.91 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.315 -0.866 . . . . 0.0 108.931 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.562 ' H ' ' C ' ' A' ' 54' ' ' VAL . 16.0 ttmm -77.74 161.49 27.67 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.127 -0.983 . . . . 0.0 108.873 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -77.13 90.64 3.66 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 109.027 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.464 ' O ' ' O ' ' A' ' 61' ' ' HIS . 11.1 m0 -72.8 -58.15 3.56 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.344 -0.848 . . . . 0.0 109.106 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.5 t -42.25 -56.87 2.76 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.288 0.565 . . . . 0.0 110.463 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -53.87 -45.99 71.16 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 58' ' ' TRP . 51.6 m170 -72.94 121.03 19.4 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.794 0.807 . . . . 0.0 110.127 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -134.45 177.96 7.36 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.843 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.45 140.47 29.78 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.894 -1.129 . . . . 0.0 109.705 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.488 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.49 151.37 48.93 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.35 94.08 4.84 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.064 -1.022 . . . . 0.0 108.659 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.431 ' OE2' ' OE1' ' A' ' 91' ' ' GLN . 10.6 pt-20 -55.4 -23.42 24.61 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.327 -0.858 . . . . 0.0 110.886 -179.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.534 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.9 mmtp -69.34 -9.32 52.83 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -133.63 -11.81 2.7 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.068 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.6 45.54 28.43 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -112.36 -172.32 2.02 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.441 0.639 . . . . 0.0 109.798 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.535 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.79 99.65 5.63 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 177.391 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.1 mt -59.88 84.93 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.667 1.222 . . . . 0.0 110.73 -176.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -121.92 10.39 10.17 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -84.66 33.47 0.52 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.512 HG23 ' H ' ' A' ' 42' ' ' GLY . 24.0 m -49.63 -10.01 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 0.0 109.579 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' LYS . 12.8 m80 -55.61 -15.05 2.5 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.187 -0.945 . . . . 0.0 109.89 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -138.07 -122.25 0.13 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.227 -0.921 . . . . 0.0 109.413 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.577 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -151.96 -164.53 2.0 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.15 -1.594 . . . . 0.0 111.11 -178.374 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.566 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.3 mp -71.53 -56.0 6.75 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -43.15 -48.52 6.38 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.667 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.501 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -57.15 -30.41 64.42 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.931 -178.59 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.501 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -88.76 -44.7 10.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.135 -0.978 . . . . 0.0 108.575 179.712 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 111.23 27.24 4.29 Favored Glycine 0 N--CA 1.501 3.005 0 N-CA-C 108.515 -1.834 . . . . 0.0 108.515 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.538 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 38.8 mt -82.61 160.96 3.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.788 -0.83 . . . . 0.0 109.614 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -166.65 -173.3 2.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.439 -0.788 . . . . 0.0 108.894 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.48 -22.65 67.03 Favored 'General case' 0 C--N 1.298 -1.673 0 O-C-N 121.466 -0.771 . . . . 0.0 110.137 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.26 -8.84 59.35 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.098 -179.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.488 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.04 113.73 26.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.562 -0.711 . . . . 0.0 109.099 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -94.43 117.33 29.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.974 -1.079 . . . . 0.0 109.527 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.435 ' HG ' HD12 ' A' ' 20' ' ' LEU . 8.9 mt -95.7 176.89 5.98 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.484 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.9 mt-30 -131.88 168.13 18.39 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -122.38 91.9 3.6 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.501 2.091 0 O-C-N 121.65 -0.656 . . . . 0.0 109.834 -177.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -57.28 135.18 56.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.742 -1.224 . . . . 0.0 110.523 -178.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.549 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.97 103.99 13.67 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.372 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.0 t -49.46 125.86 12.09 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 122.045 0.926 . . . . 0.0 109.786 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.27 -34.77 5.31 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 106.406 -2.678 . . . . 0.0 106.406 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -105.12 -35.75 7.51 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.21 56.45 6.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.736 1.255 . . . . 0.0 109.826 -178.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -140.63 123.89 10.14 Favored Pre-proline 0 C--N 1.294 -1.826 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 177.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -43.84 134.42 7.84 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 CA-C-N 120.429 1.189 . . . . 0.0 114.825 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.549 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.5 mt -93.02 99.99 10.58 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 67.1 p -101.45 93.14 5.24 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.241 -0.912 . . . . 0.0 111.22 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.5 -94.35 0.14 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.323 -2.311 . . . . 0.0 107.323 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.471 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -115.88 152.47 33.33 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.78 126.9 15.61 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.981 -1.074 . . . . 0.0 111.5 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . 0.488 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 49.6 mt -91.02 146.27 6.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.688 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 9.3 m -121.03 146.25 46.91 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.939 0.876 . . . . 0.0 109.091 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.735 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.83 -128.87 0.26 Allowed 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 5.9 mtp -65.89 26.09 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.569 -0.707 . . . . 0.0 109.11 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.735 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.28 -8.97 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 148.53 27.89 Favored 'General case' 0 C--N 1.306 -1.298 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -94.65 174.8 6.93 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.64 134.96 7.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.442 -1.303 . . . . 0.0 109.929 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.4 m80 -55.91 115.33 9.36 Favored Pre-proline 0 C--N 1.302 -1.473 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.578 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 44.3 Cg_exo -45.75 -11.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.317 1.149 . . . . 0.0 111.586 -178.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.74 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.2 mt-10 -98.3 -52.87 3.52 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 122.102 0.953 . . . . 0.0 110.077 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.532 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.1 m170 -57.04 -4.58 0.19 Allowed 'General case' 0 C--N 1.292 -1.901 0 O-C-N 120.633 -1.292 . . . . 0.0 109.715 -179.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' B' ' 571' ' ' GLU . 14.0 t80 -127.55 54.43 1.68 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.74 HG13 ' O ' ' B' ' 571' ' ' GLU . 13.8 m -93.53 177.58 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 121.624 0.726 . . . . 0.0 110.147 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.659 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.88 141.42 32.24 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.369 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . 0.488 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.52 76.41 6.6 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 116.719 -1.992 . . . . 0.0 108.801 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -153.1 -61.52 0.15 Allowed 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 102.498 -3.149 . . . . 0.0 102.498 174.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 20.8 p -120.16 81.57 1.76 Allowed 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 111.647 -2.524 . . . . 0.0 104.803 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.2 mt -53.02 15.48 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.53 -38.15 17.5 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 119.636 -1.915 . . . . 0.0 112.258 -178.547 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.578 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.8 tp60 -161.09 142.36 11.69 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 119.673 -1.892 . . . . 0.0 114.341 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.659 HD13 ' HB2' ' B' ' 575' ' ' CYS . 24.0 tp -134.06 171.02 14.79 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 74.0 m-20 -146.77 128.53 15.27 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.186 -0.947 . . . . 0.0 109.468 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.688 ' CE ' ' H ' ' B' ' 562' ' ' THR . 4.5 ptpp? -50.66 -19.41 0.92 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.622 -0.673 . . . . 0.0 110.014 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -85.51 -21.15 55.01 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.894 -1.683 . . . . 0.0 108.894 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -133.75 28.63 3.9 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.69 107.05 18.87 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 122.788 1.28 . . . . 0.0 110.288 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.516 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -100.88 168.46 9.62 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 12.0 tt0 -152.4 157.22 40.93 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.795 -1.191 . . . . 0.0 110.673 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.598 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 1.2 tp-100 -154.15 145.83 23.31 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.551 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 45.68 23.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.03 -1.044 . . . . 0.0 109.872 -179.719 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.77 -4.85 1.54 Allowed 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.386 0.612 . . . . 0.0 110.482 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -88.59 121.19 70.24 Favored Pre-proline 0 C--N 1.294 -1.825 0 O-C-N 121.306 -0.871 . . . . 0.0 109.394 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.44 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 49.7 Cg_exo -48.84 164.64 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.22 0 CA-C-N 120.106 1.073 . . . . 0.0 111.782 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' B' ' 588' ' ' LYS . 7.4 m-85 -170.75 142.08 1.91 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.024 -1.048 . . . . 0.0 110.373 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . 0.43 ' HG ' ' CB ' ' B' ' 575' ' ' CYS . 22.4 m -77.8 154.78 31.57 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.589 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.58 -58.3 9.07 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 179.113 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -46.17 -26.64 0.81 Allowed 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.675 -0.64 . . . . 0.0 109.484 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.4 m -85.0 -63.9 1.25 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.544 -0.722 . . . . 0.0 109.099 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -52.49 -53.85 40.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.519 -0.738 . . . . 0.0 109.355 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.635 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -49.59 -42.33 44.33 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.52 -24.73 14.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.364 -0.835 . . . . 0.0 109.559 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.8 mt -93.76 -57.21 2.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.251 -0.906 . . . . 0.0 111.685 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.598 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.6 m-85 -87.16 31.5 0.72 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.046 -1.034 . . . . 0.0 110.253 -178.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.943 -1.098 . . . . 0.0 109.447 179.253 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.429 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.557 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -84.61 125.55 32.55 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.118 -1.225 . . . . 0.0 109.44 179.789 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.87 118.96 23.58 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.61 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.06 127.44 32.91 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.068 -1.053 . . . . 0.0 108.368 -179.769 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.493 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -82.82 134.02 35.12 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 179.568 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -76.78 145.66 38.38 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.414 ' N ' ' O ' ' A' ' 31' ' ' VAL . 14.3 t -137.57 105.85 3.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 CA-C-O 121.784 0.802 . . . . 0.0 110.036 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.499 ' NE2' ' OD1' ' A' ' 30' ' ' ASP . 23.7 m80 -82.5 103.53 12.11 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -73.72 120.18 22.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.498 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 p -80.35 -60.51 2.29 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.06 -1.025 . . . . 0.0 111.064 -177.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.435 ' N ' ' OG1' ' A' ' 25' ' ' THR . 14.0 t0 -50.04 -11.01 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.755 -1.215 . . . . 0.0 109.853 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 25' ' ' THR . 2.6 mt -119.13 -37.17 3.24 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 85.93 8.15 0.33 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 122.364 -0.21 . . . . 0.0 111.555 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.642 ' NH1' HD22 ' A' ' 52' ' ' LEU . 27.5 ptt180 -93.28 -175.75 3.92 Favored 'General case' 0 C--N 1.31 -1.112 0 O-C-N 120.487 -1.383 . . . . 0.0 109.236 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' NE2' ' A' ' 23' ' ' HIS . 20.6 m-20 -131.97 115.81 16.33 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.705 0.764 . . . . 0.0 109.125 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.422 HG12 ' N ' ' A' ' 32' ' ' THR . 35.7 t -109.21 157.2 9.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.426 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.5 131.84 40.31 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 179.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.426 HD22 ' C ' ' A' ' 32' ' ' THR . 2.1 mm? -113.8 113.08 24.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.617 -0.677 . . . . 0.0 109.291 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.557 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 10.7 tpt180 -60.03 104.17 0.28 Allowed 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.28 -169.54 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 122.119 0.961 . . . . 0.0 110.89 -178.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.414 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.4 p -144.93 172.42 13.06 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.16 43.48 2.25 Favored Glycine 0 N--CA 1.483 1.804 0 N-CA-C 108.921 -1.672 . . . . 0.0 108.921 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.48 ' C ' HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -142.39 3.61 1.53 Allowed 'General case' 0 N--CA 1.486 1.327 0 O-C-N 121.608 -0.936 . . . . 0.0 108.785 179.815 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -90.45 133.4 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.142 -0.974 . . . . 0.0 110.142 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.4 m-70 -76.24 144.2 40.51 Favored 'General case' 0 C--N 1.293 -1.867 0 O-C-N 120.814 -1.179 . . . . 0.0 108.579 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.457 ' C ' ' N ' ' A' ' 43' ' ' GLY . 82.5 mt -49.08 -51.53 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.992 -1.068 . . . . 0.0 109.101 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.55 -15.99 4.84 Favored Glycine 0 N--CA 1.484 1.847 0 N-CA-C 108.283 -1.927 . . . . 0.0 108.283 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.457 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -85.43 -25.85 38.06 Favored Glycine 0 N--CA 1.485 1.935 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 41' ' ' ILE . 38.5 t -81.44 -50.1 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.527 -0.984 . . . . 0.0 109.35 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.418 ' HB2' ' NE2' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -55.67 -41.0 73.04 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.806 -1.184 . . . . 0.0 108.419 179.406 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.59 HD12 HD13 ' B' ' 603' ' ' LEU . 5.8 tt -50.24 -58.56 5.34 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.239 -0.913 . . . . 0.0 109.174 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 48' ' ' LEU . 61.8 mttm -52.13 -54.54 29.36 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.468 -0.77 . . . . 0.0 110.561 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 48' ' ' LEU . 4.0 mm? -45.67 -61.89 1.52 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.547 -1.346 . . . . 0.0 108.822 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 53' ' ' ASP . 97.4 t -52.69 -49.87 44.03 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 O-C-N 121.526 -0.733 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -46.3 -40.61 11.97 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.714 -1.241 . . . . 0.0 109.711 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.425 ' NZ ' HD11 ' A' ' 33' ' ' LEU . 54.5 mttp -69.3 -57.63 5.06 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.322 -0.861 . . . . 0.0 110.325 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.642 HD22 ' NH1' ' A' ' 29' ' ' ARG . 16.2 tp -110.34 41.98 1.65 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.475 1.131 . . . . 0.0 109.56 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.626 ' N ' ' O ' ' A' ' 49' ' ' VAL . 36.4 t0 -52.08 -84.92 0.01 OUTLIER 'General case' 0 C--N 1.263 -3.186 0 CA-C-O 122.232 1.015 . . . . 0.0 109.291 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 55' ' ' LYS . 14.1 p 43.14 179.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.277 -2.569 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.861 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.737 ' H ' HG22 ' A' ' 54' ' ' VAL . 0.7 OUTLIER -77.33 30.49 0.15 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.643 -1.286 . . . . 0.0 108.208 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.621 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 36.7 tttm -79.57 137.42 37.15 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.081 -1.048 . . . . 0.0 109.033 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -50.95 112.44 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.567 -0.708 . . . . 0.0 110.126 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.621 ' CH2' ' NZ ' ' A' ' 56' ' ' LYS . 12.7 m95 -127.44 -21.34 3.85 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.708 0.766 . . . . 0.0 109.788 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.2 t -40.05 -52.79 2.48 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.2 -0.938 . . . . 0.0 111.369 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.421 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 17.2 t0 -83.62 13.37 4.68 Favored 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.537 -0.727 . . . . 0.0 110.963 -178.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.62 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 3.6 p-80 -71.59 148.75 46.3 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 120.741 -1.224 . . . . 0.0 111.988 -178.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.98 155.22 5.5 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -93.93 148.46 22.13 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.532 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.25 151.52 48.61 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.333 -0.854 . . . . 0.0 108.913 -178.982 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -112.65 94.65 5.01 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.903 . . . . 0.0 108.639 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -55.77 -23.9 32.36 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.245 -0.909 . . . . 0.0 110.872 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.529 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -68.8 -9.03 48.69 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 178.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.56 -12.22 2.7 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.842 -178.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.1 mpp_? 52.43 45.77 27.91 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -113.37 -173.35 2.24 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.673 0.749 . . . . 0.0 110.143 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.32 101.64 7.06 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.721 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' LEU . 34.4 mt -61.74 86.06 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.292 0 O-C-N 120.433 -1.417 . . . . 0.0 110.892 -176.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 8.74 11.39 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.529 ' C ' ' H ' ' A' ' 76' ' ' HIS . 9.5 mmpt? -74.93 58.53 0.85 Allowed 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.1 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.587 HG21 ' O ' ' B' ' 602' ' ' LYS . 0.9 OUTLIER -58.82 -5.95 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.694 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -36.03 -63.44 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.883 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.417 ' HB3' ' H ' ' A' ' 78' ' ' THR . 1.2 t90 -130.78 -100.04 0.31 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.222 -0.924 . . . . 0.0 111.221 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -151.35 -164.38 1.98 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 119.671 -1.893 . . . . 0.0 111.365 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.595 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -68.8 -57.79 5.09 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -42.35 -46.7 4.7 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.499 ' HD2' ' H ' ' A' ' 78' ' ' THR . 0.0 OUTLIER -62.23 -28.93 70.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.487 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -85.79 -47.4 9.76 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.418 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 113.59 21.71 5.68 Favored Glycine 0 N--CA 1.499 2.854 0 N-CA-C 108.088 -2.005 . . . . 0.0 108.088 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 36.4 mt -82.53 161.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.877 -0.778 . . . . 0.0 109.907 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -167.76 -163.4 0.49 Allowed 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.37 -27.12 62.18 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.435 -0.791 . . . . 0.0 109.598 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.71 -14.46 62.46 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.463 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.32 113.93 26.51 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -94.67 118.85 32.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.015 -1.053 . . . . 0.0 109.577 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.493 ' HG ' HD12 ' A' ' 20' ' ' LEU . 9.4 mt -96.0 176.94 5.92 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.714 0.768 . . . . 0.0 109.675 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.532 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 10.0 mt-30 -131.13 165.56 23.02 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 58' ' ' TRP . 31.8 t80 -133.8 90.92 2.76 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.987 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.663 -178.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.552 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m . . . . . 0 N--CA 1.488 1.474 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.84 135.21 57.71 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 120.774 -1.204 . . . . 0.0 110.39 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.484 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.72 103.82 13.32 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 178.247 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -50.8 127.05 17.42 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-O 122.14 0.972 . . . . 0.0 109.601 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.68 -34.56 5.4 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 106.043 -2.823 . . . . 0.0 106.043 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -106.04 -35.71 7.17 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.452 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.03 56.31 6.73 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 122.663 1.22 . . . . 0.0 109.968 -178.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -140.72 124.17 10.18 Favored Pre-proline 0 C--N 1.293 -1.855 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.4 135.14 9.14 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.452 1.197 . . . . 0.0 114.583 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.552 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.8 mt -93.64 98.49 8.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.4 p -99.52 91.36 4.87 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.29 -0.881 . . . . 0.0 111.313 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.63 -95.31 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.455 -2.258 . . . . 0.0 107.455 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.478 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.28 151.66 32.55 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.56 126.3 15.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.964 -1.085 . . . . 0.0 111.556 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . 0.477 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 46.8 mt -91.29 146.86 5.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.735 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.3 m -117.41 147.06 43.02 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-O 121.888 0.851 . . . . 0.0 109.336 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.29 -129.17 0.26 Allowed 'General case' 0 C--N 1.295 -1.789 0 CA-C-O 121.499 0.666 . . . . 0.0 109.383 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.73 26.13 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.19 -9.03 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.89 163.56 22.17 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -106.1 174.25 5.97 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.14 138.11 9.96 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.33 -1.348 . . . . 0.0 109.813 -179.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.596 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.4 m80 -57.16 116.24 12.98 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 177.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.565 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 52.7 Cg_exo -45.13 -10.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.461 0 CA-C-N 120.311 1.147 . . . . 0.0 111.894 -178.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.922 ' O ' HG13 ' B' ' 574' ' ' VAL . 12.4 mt-10 -100.06 -52.42 3.42 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.018 0.913 . . . . 0.0 110.042 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.486 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.5 m170 -58.01 -4.25 0.31 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.864 -1.147 . . . . 0.0 109.81 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.1 t80 -125.91 54.66 1.5 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.922 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.4 m -93.9 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 CA-C-O 121.925 0.869 . . . . 0.0 110.616 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.634 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.29 143.6 31.19 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.626 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.47 74.76 3.29 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 116.672 -2.011 . . . . 0.0 109.84 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . 0.568 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 0.3 OUTLIER -153.65 -48.31 0.09 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 102.047 -3.316 . . . . 0.0 102.047 173.244 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.544 ' SG ' ' O ' ' B' ' 578' ' ' CYS . 29.5 p -132.0 81.52 1.97 Allowed 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 176.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.8 mt -53.1 15.65 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.47 -37.38 18.34 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 119.686 -1.884 . . . . 0.0 112.628 -178.255 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.565 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -160.3 140.72 11.69 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 119.596 -1.94 . . . . 0.0 114.448 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.634 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.6 tp -137.77 169.82 17.13 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.5 m-20 -146.22 133.58 20.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.27 -0.894 . . . . 0.0 109.429 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.735 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 2.7 ptpp? -55.38 -14.4 1.89 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.703 0.763 . . . . 0.0 109.518 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -92.9 -16.08 49.61 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -137.31 28.58 2.77 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 3.7 p90 -89.17 111.71 22.55 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 122.304 1.05 . . . . 0.0 109.814 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.56 167.12 10.0 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.873 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.439 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.6 tt0 -152.84 157.56 40.9 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.665 -1.272 . . . . 0.0 110.855 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.543 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.3 tp-100 -159.25 146.53 17.18 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 106.214 -1.773 . . . . 0.0 106.214 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.615 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.1 22.62 0.43 Allowed 'General case' 0 C--N 1.296 -1.726 0 O-C-N 120.954 -1.091 . . . . 0.0 109.505 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.472 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 80.72 -5.75 1.7 Allowed 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.718 -0.614 . . . . 0.0 110.849 178.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . 0.475 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 31.8 mttm -90.5 116.86 67.34 Favored Pre-proline 0 C--N 1.294 -1.824 0 O-C-N 121.22 -0.925 . . . . 0.0 109.483 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.527 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 36.0 Cg_exo -49.52 165.9 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.303 0 CA-C-N 120.026 1.045 . . . . 0.0 112.13 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 42.2 m-85 -170.13 138.68 1.7 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.24 -0.912 . . . . 0.0 109.776 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.3 m -69.57 152.84 44.3 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.343 -2.466 . . . . 0.0 104.343 174.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.54 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -57.0 -56.9 15.78 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -45.85 -30.61 1.76 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.462 -0.773 . . . . 0.0 109.731 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . 0.568 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 81.0 m -81.23 -60.96 2.09 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.262 -0.898 . . . . 0.0 108.806 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.583 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -57.42 -53.63 55.96 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.124 0.488 . . . . 0.0 110.187 -179.595 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.71 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -49.83 -43.47 48.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.981 -1.074 . . . . 0.0 109.108 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.587 ' O ' HG21 ' A' ' 75' ' ' THR . 60.0 tttt -55.77 -21.06 17.15 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.104 -0.997 . . . . 0.0 109.46 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.59 HD13 HD12 ' A' ' 46' ' ' LEU . 4.8 mt -91.92 -56.75 2.97 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.28 -0.887 . . . . 0.0 110.194 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -98.85 30.25 3.43 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.192 -0.943 . . . . 0.0 109.438 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.493 1.69 0 O-C-N 120.836 -1.165 . . . . 0.0 109.224 179.603 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.551 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.497 2.715 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.684 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 39.3 p -79.93 130.02 34.96 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.318 -1.107 . . . . 0.0 109.511 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.551 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -148.81 126.09 11.5 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.857 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -81.27 130.21 34.93 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.979 -1.076 . . . . 0.0 109.895 -179.68 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.73 HD11 ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.47 133.03 34.49 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.343 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.46 142.67 39.04 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.017 -1.052 . . . . 0.0 108.595 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 90' ' ' LEU . 24.8 t -136.25 109.93 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 CA-C-O 121.965 0.888 . . . . 0.0 109.992 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 9.4 m-70 -85.72 103.84 14.88 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.8 t -72.53 109.95 5.2 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.643 -1.223 . . . . 0.0 107.796 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.462 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -80.38 -39.29 28.69 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.166 -0.959 . . . . 0.0 109.588 -178.86 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 8.7 t0 -67.65 3.15 1.5 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.0 108.89 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.472 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.3 mt -139.63 -28.6 0.76 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.492 -0.755 . . . . 0.0 109.093 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 82.55 12.88 0.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 122.124 -0.36 . . . . 0.0 110.432 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.4 mtp-105 -94.87 -178.27 4.45 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.854 -1.154 . . . . 0.0 109.72 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 40.7 m-20 -138.38 115.98 11.35 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.415 HG12 ' N ' ' A' ' 32' ' ' THR . 18.5 t -117.16 157.69 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 CA-C-O 121.666 0.746 . . . . 0.0 110.145 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.451 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.18 130.32 38.99 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.451 HD22 ' O ' ' A' ' 32' ' ' THR . 2.9 mm? -116.73 115.88 26.47 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.684 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -61.37 138.48 58.25 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 34' ' ' ARG . 11.5 m -160.33 -169.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.438 0 CA-C-O 121.788 0.804 . . . . 0.0 109.241 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.475 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.7 p -145.18 165.13 29.23 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 178.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -74.16 43.93 1.3 Allowed Glycine 0 C--N 1.292 -1.887 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.499 ' HA ' HG21 ' A' ' 78' ' ' THR . 0.8 OUTLIER -144.27 3.99 1.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.684 -0.892 . . . . 0.0 108.943 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.674 ' O ' HG22 ' A' ' 78' ' ' THR . 3.0 m -90.12 149.51 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.116 -0.99 . . . . 0.0 110.05 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -85.31 142.48 29.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.829 -1.17 . . . . 0.0 108.045 178.791 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 94.3 mt -47.77 -54.9 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.081 -1.012 . . . . 0.0 109.041 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.541 ' H ' HG23 ' A' ' 75' ' ' THR . . . -55.2 -17.04 10.03 Favored Glycine 0 N--CA 1.484 1.882 0 N-CA-C 108.224 -1.95 . . . . 0.0 108.224 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -70.84 -29.31 69.45 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.319 -1.912 . . . . 0.0 108.319 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.26 -36.36 12.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 33.1 mtm -51.29 -37.02 45.21 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.7 tp -69.89 -65.95 0.65 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.461 0.648 . . . . 0.0 110.66 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.9 mtmm -53.81 -55.7 24.17 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.41 -0.806 . . . . 0.0 111.467 -178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.412 HD21 ' CD1' ' A' ' 92' ' ' PHE . 62.2 tp -45.98 -48.67 16.5 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.875 -1.14 . . . . 0.0 109.958 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.9 t -67.8 -46.1 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.972 -1.08 . . . . 0.0 109.633 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -45.28 -38.43 5.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.284 -0.885 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -66.59 -44.69 81.48 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.369 -0.832 . . . . 0.0 109.992 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -60.13 -65.18 0.72 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.011 -1.056 . . . . 0.0 108.361 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.5 t70 76.44 80.83 0.09 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.964 0.887 . . . . 0.0 110.561 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.494 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.32 140.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.633 ' HZ2' HD12 ' B' ' 579' ' ' LEU . 1.8 tptp -69.18 35.67 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.376 -0.827 . . . . 0.0 109.946 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 54' ' ' VAL . 11.6 ttmm -78.44 147.12 34.12 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.989 -1.07 . . . . 0.0 109.024 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.522 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -61.86 107.03 0.77 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.537 -0.727 . . . . 0.0 109.377 179.805 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.511 ' O ' ' N ' ' A' ' 61' ' ' HIS . 75.8 m95 -106.42 -35.12 7.2 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.373 -0.83 . . . . 0.0 110.224 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.405 ' C ' ' O ' ' A' ' 58' ' ' TRP . 1.5 t -41.57 -51.21 3.99 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.457 -0.777 . . . . 0.0 109.826 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -56.6 -37.73 71.06 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.522 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 11.1 m-70 -72.64 134.79 45.28 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-O 121.649 0.738 . . . . 0.0 109.849 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -145.95 174.83 10.92 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.766 HD22 ' N ' ' A' ' 63' ' ' LEU . 2.1 mm? -94.54 141.02 29.08 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.885 -1.134 . . . . 0.0 109.978 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.497 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -125.32 151.12 46.46 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.674 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.541 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.03 93.64 4.58 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.041 -1.037 . . . . 0.0 108.652 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.72 -24.21 21.11 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.179 -0.951 . . . . 0.0 111.043 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.533 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -67.97 -9.44 45.43 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -133.78 -12.53 2.61 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.955 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 52.49 45.74 28.0 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.0 t -112.13 -171.49 1.86 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.393 0.616 . . . . 0.0 109.697 -178.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.544 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.89 99.14 5.4 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 177.147 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -60.3 83.94 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 122.594 1.188 . . . . 0.0 110.608 -176.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.4 pp -118.97 6.97 11.36 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 178.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.508 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -83.63 57.31 4.01 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.594 HG21 ' O ' ' B' ' 602' ' ' LYS . 5.4 m -49.71 -11.65 0.06 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.056 -1.028 . . . . 0.0 109.126 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.508 ' N ' ' O ' ' A' ' 74' ' ' LYS . 41.1 m80 -64.45 150.06 47.28 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.404 -0.81 . . . . 0.0 109.786 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 78.8 m95 54.98 -129.26 2.16 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.756 -0.59 . . . . 0.0 110.319 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.674 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -156.24 -163.66 1.51 Allowed 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 118.262 -1.375 . . . . 0.0 112.886 -177.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.595 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.3 mp -69.03 -56.06 8.92 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -44.82 -46.29 10.6 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.731 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -58.3 -31.24 67.31 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.768 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.519 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -85.11 -46.23 11.32 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.13 14.32 7.19 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 108.631 -1.787 . . . . 0.0 108.631 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.538 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 35.8 mt -72.61 161.53 4.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.726 -0.867 . . . . 0.0 109.902 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.38 -171.97 1.18 Allowed 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.45 -20.02 65.44 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 109.993 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.506 ' OD2' ' N ' ' A' ' 88' ' ' ALA . 46.0 p-10 -79.92 -21.0 44.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.73 ' O ' HD11 ' A' ' 20' ' ' LEU . . . -103.47 112.39 25.27 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.893 ' O ' HD23 ' A' ' 90' ' ' LEU . 4.6 ptpp? -98.41 174.5 6.44 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.035 -1.04 . . . . 0.0 110.317 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.893 HD23 ' O ' ' A' ' 89' ' ' LYS . 2.3 mt -138.13 179.69 6.3 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.913 0.863 . . . . 0.0 109.368 -178.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.482 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.3 mt-30 -129.81 168.55 16.39 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.412 ' CD1' HD21 ' A' ' 48' ' ' LEU . 14.6 t80 -131.39 99.5 4.85 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.753 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.729 -176.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.535 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.4 m . . . . . 0 N--CA 1.487 1.408 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.8 mp -56.35 134.97 53.97 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 120.818 -1.176 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.554 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.61 104.26 14.44 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.3 t -49.38 126.08 12.41 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 122.139 0.971 . . . . 0.0 109.89 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.18 -35.95 4.63 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 106.381 -2.688 . . . . 0.0 106.381 -177.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.8 m -103.53 -35.99 8.12 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.453 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 55.25 56.07 6.83 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.819 1.295 . . . . 0.0 109.861 -178.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -140.94 124.1 9.93 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -43.57 134.73 7.07 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 CA-C-N 120.461 1.2 . . . . 0.0 114.956 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.554 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.2 mt -92.88 98.3 8.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -98.48 92.54 5.7 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.196 -0.94 . . . . 0.0 111.398 -177.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.56 -96.26 0.16 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 107.421 -2.271 . . . . 0.0 107.421 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.467 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 7.2 mmt180 -114.88 153.09 31.12 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 177.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -144.49 126.79 15.77 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.923 -1.111 . . . . 0.0 111.373 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.3 mt -90.38 146.05 6.67 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.41 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 10.1 m -121.71 146.28 47.18 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 122.008 0.908 . . . . 0.0 109.018 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.712 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.27 -128.73 0.27 Allowed 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.546 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.6 mtt -66.0 26.19 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.531 -0.731 . . . . 0.0 109.081 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.712 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.08 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.46 147.78 28.53 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -94.46 174.59 7.05 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.212 -0.93 . . . . 0.0 108.556 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.9 136.49 7.99 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.767 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.579 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -56.84 116.29 12.78 Favored Pre-proline 0 C--N 1.3 -1.575 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 39.1 Cg_exo -46.67 -10.2 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.471 0 CA-C-N 120.359 1.164 . . . . 0.0 111.399 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.918 ' O ' HG13 ' B' ' 574' ' ' VAL . 14.0 mt-10 -98.07 -52.08 3.82 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 122.019 0.914 . . . . 0.0 110.066 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.497 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 20.4 m170 -58.64 -4.17 0.39 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 120.949 -1.094 . . . . 0.0 109.764 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.437 ' H ' ' C ' ' B' ' 571' ' ' GLU . 17.0 t80 -128.09 58.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.918 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.31 177.45 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.709 0.766 . . . . 0.0 111.359 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.589 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.48 147.36 35.92 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.84 74.35 3.58 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 116.595 -2.042 . . . . 0.0 110.033 179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -154.14 -65.61 0.14 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 102.436 -3.172 . . . . 0.0 102.436 172.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -111.04 82.06 1.53 Allowed 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.296 -2.229 . . . . 0.0 105.238 177.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 0.846 HD22 ' N ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.0 15.4 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -176.677 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.5 -36.66 16.3 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 119.595 -1.941 . . . . 0.0 113.016 -178.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.4 tp60 -159.76 139.8 11.7 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 119.359 -2.088 . . . . 0.0 115.179 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.1 tp -139.53 168.7 19.22 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.2 m-20 -150.2 133.53 16.41 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.156 -0.965 . . . . 0.0 109.264 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.41 ' HE3' ' H ' ' B' ' 562' ' ' THR . 9.0 ptpt -51.3 -18.11 0.89 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.482 -0.761 . . . . 0.0 109.432 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -19.32 53.11 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 -179.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . 0.404 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.7 p -134.31 25.58 3.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.559 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.6 109.87 21.02 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.339 1.066 . . . . 0.0 109.897 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.18 159.28 15.68 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 179.647 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.6 tt0 -154.39 156.94 37.77 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.624 1.202 . . . . 0.0 111.147 -178.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.438 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 2.4 pt20 -157.25 145.79 19.57 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.677 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.47 23.82 0.65 Allowed 'General case' 0 C--N 1.289 -2.033 0 O-C-N 121.318 -0.864 . . . . 0.0 109.277 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 83.41 -7.91 1.12 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.915 -0.491 . . . . 0.0 111.958 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -85.72 115.82 63.16 Favored Pre-proline 0 C--N 1.296 -1.738 0 O-C-N 120.966 -1.084 . . . . 0.0 110.763 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 29.1 Cg_exo -53.99 161.92 4.45 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 CA-C-N 120.018 1.042 . . . . 0.0 112.436 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.2 m-85 -171.47 141.68 1.56 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.473 -0.767 . . . . 0.0 109.621 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.0 m -71.21 154.58 41.56 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 104.434 -2.432 . . . . 0.0 104.434 174.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.589 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.03 -55.32 36.48 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.76 -27.89 1.35 Allowed 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.648 -0.657 . . . . 0.0 109.47 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 52.4 m -85.27 -56.99 3.26 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 2.3 t80 -57.93 -54.23 49.32 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.676 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.06 -39.58 56.33 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.0 108.549 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.594 ' O ' HG21 ' A' ' 75' ' ' THR . 0.7 OUTLIER -54.69 -30.75 56.59 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.533 -0.73 . . . . 0.0 110.036 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.45 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -94.36 -57.48 2.49 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.246 -0.909 . . . . 0.0 111.761 -177.035 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.507 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 5.7 m-85 -88.81 24.58 2.0 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.106 -0.996 . . . . 0.0 110.517 -178.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.507 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 2.3 m . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.029 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.443 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.1 p -79.19 122.63 26.52 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.622 -0.928 . . . . 0.0 110.218 -179.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.443 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -132.85 122.25 24.14 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.624 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.66 134.72 40.51 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.498 -179.275 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.708 HD21 HG22 ' A' ' 84' ' ' ILE . 0.1 OUTLIER -83.66 131.24 34.96 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.244 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -77.57 145.45 36.85 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.069 -1.019 . . . . 0.0 108.589 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.0 t -139.58 130.63 32.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.445 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 43.5 m80 -105.76 103.99 13.61 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.52 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.1 t -75.06 115.51 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 118.514 -1.274 . . . . 0.0 108.668 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.37 -43.02 21.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.323 -0.861 . . . . 0.0 110.227 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 3.2 p-10 -64.26 -11.33 30.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.929 -1.107 . . . . 0.0 109.48 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 27' ' ' LEU . 3.6 mm? -122.6 -24.16 4.98 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.542 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 73.03 13.29 4.9 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 -177.638 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.3 mtp180 -89.02 -177.11 5.38 Favored 'General case' 0 C--N 1.307 -1.264 0 O-C-N 121.195 -0.941 . . . . 0.0 109.455 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.445 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 0.8 OUTLIER -138.45 118.46 13.39 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 178.022 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 20.3 t -118.41 155.93 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.716 0.77 . . . . 0.0 110.486 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.425 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.66 131.12 39.16 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.111 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.447 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 1.8 mm? -114.78 112.94 23.57 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.53 -0.732 . . . . 0.0 109.981 -178.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -60.98 104.99 0.42 Allowed 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.5 m -136.0 -169.12 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 121.857 0.837 . . . . 0.0 110.099 -178.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.1 p -142.62 171.16 14.43 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.25 47.1 2.86 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 108.585 -1.806 . . . . 0.0 108.585 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -146.04 0.25 0.82 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.687 -0.89 . . . . 0.0 108.955 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.569 ' O ' HG22 ' A' ' 78' ' ' THR . 1.6 m -90.2 145.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.179 -0.951 . . . . 0.0 109.447 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.534 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -78.91 133.65 36.92 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 177.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -36.45 29.03 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 O-C-N 120.546 -1.347 . . . . 0.0 108.022 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.09 -22.37 49.06 Favored Glycine 0 N--CA 1.484 1.861 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.42 -22.94 78.68 Favored Glycine 0 C--O 1.209 -1.463 0 N-CA-C 108.016 -2.033 . . . . 0.0 108.016 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.19 -33.85 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 61' ' ' HIS . 32.6 mtm -51.97 -39.19 58.93 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.666 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -77.11 -59.97 2.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.746 -0.596 . . . . 0.0 111.457 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -46.37 -56.06 6.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.812 -1.18 . . . . 0.0 110.112 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -46.52 -60.94 2.05 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.02 -1.05 . . . . 0.0 109.76 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 53.1 t -53.25 -47.78 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 120.969 -1.082 . . . . 0.0 110.056 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -45.51 -42.98 11.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.133 -0.979 . . . . 0.0 109.816 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.447 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 55.0 mttp -62.94 -43.02 99.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.374 -0.829 . . . . 0.0 110.162 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.441 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -62.0 -66.72 0.5 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.515 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.87 82.57 0.1 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.994 0.902 . . . . 0.0 110.119 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.513 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.2 p -171.41 141.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.571 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -67.43 32.68 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.427 -0.795 . . . . 0.0 109.671 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.614 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 20.1 ttpp -78.76 139.71 38.38 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.849 -1.157 . . . . 0.0 109.552 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -49.96 118.42 2.89 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.381 -0.824 . . . . 0.0 109.352 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.63 ' O ' ' CG ' ' A' ' 61' ' ' HIS . 61.2 m95 -118.94 -23.62 6.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.484 -0.76 . . . . 0.0 110.431 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.419 ' C ' ' H ' ' A' ' 61' ' ' HIS . 0.3 OUTLIER -44.85 -54.35 6.51 Favored 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.678 -1.264 . . . . 0.0 110.122 -179.206 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 49.0 t0 -59.8 -2.96 0.44 Allowed 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.436 -0.79 . . . . 0.0 110.076 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.63 ' CG ' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -75.12 149.53 39.05 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 -179.446 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.4 ' C ' HD22 ' A' ' 63' ' ' LEU . . . -171.32 151.16 3.04 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -94.65 144.6 25.48 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.49 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.7 143.01 50.84 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.544 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -103.96 91.01 3.79 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.054 -1.029 . . . . 0.0 108.668 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.43 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.62 -22.62 14.04 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.227 -0.92 . . . . 0.0 111.205 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.46 ' HB2' ' NE1' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -64.43 -21.77 66.75 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 178.312 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.541 ' C ' HH21 ' A' ' 69' ' ' ARG . 15.3 mmtt -120.67 -12.09 8.93 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.38 -178.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.544 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.0 OUTLIER 52.9 46.53 26.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.006 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.58 -174.14 2.41 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.409 0.623 . . . . 0.0 110.125 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.527 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.57 98.39 5.01 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 177.385 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.18 92.31 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 123.04 1.4 . . . . 0.0 110.121 -176.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -125.71 6.21 7.46 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.006 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -82.59 39.83 0.63 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.463 HG21 ' HD2' ' B' ' 602' ' ' LYS . 13.9 p -46.26 -15.11 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.078 -1.014 . . . . 0.0 110.127 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 7.9 m80 -79.27 43.42 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.154 -0.966 . . . . 0.0 110.253 -179.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -176.86 -142.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.025 -1.047 . . . . 0.0 108.573 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.569 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -152.58 166.34 32.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 119.736 -1.853 . . . . 0.0 111.261 -178.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.529 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 6.5 mp -44.76 -59.02 2.72 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -45.64 -36.85 5.13 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.157 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.539 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -62.85 -35.71 80.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.031 -1.068 . . . . 0.0 108.573 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.539 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -92.71 -38.84 11.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.016 -1.053 . . . . 0.0 108.426 178.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.85 12.63 8.38 Favored Glycine 0 N--CA 1.5 2.912 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.708 HG22 HD21 ' A' ' 20' ' ' LEU . 68.1 mt -61.04 156.61 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.433 -1.04 . . . . 0.0 108.519 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.545 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.77 -174.81 1.66 Allowed 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.74 -25.13 66.25 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.374 -0.829 . . . . 0.0 109.803 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -81.14 -6.08 58.42 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.36 112.82 24.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.691 -0.631 . . . . 0.0 109.451 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.0 mmtp -97.66 116.25 29.51 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.117 -0.989 . . . . 0.0 109.255 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.6 mt -99.62 177.81 5.04 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.627 0.727 . . . . 0.0 109.698 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.49 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 7.6 mt-30 -129.84 167.02 18.78 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -133.49 95.62 3.54 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.503 2.217 0 O-C-N 121.944 -0.472 . . . . 0.0 111.275 -176.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.524 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.6 m . . . . . 0 N--CA 1.488 1.464 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -61.36 135.82 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.021 -1.049 . . . . 0.0 110.346 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.504 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.32 103.51 12.76 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 178.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.7 t -50.8 126.54 16.12 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 122.144 0.974 . . . . 0.0 109.527 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.12 5.63 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 106.301 -2.719 . . . . 0.0 106.301 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -106.45 -35.44 7.1 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.446 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.28 56.63 6.21 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 122.659 1.219 . . . . 0.0 109.972 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -140.6 123.55 9.99 Favored Pre-proline 0 C--N 1.294 -1.845 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -44.41 135.81 8.86 Favored 'Trans proline' 0 N--CA 1.494 1.502 0 CA-C-N 120.509 1.217 . . . . 0.0 114.58 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.524 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -95.19 98.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.8 p -100.91 91.26 4.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.212 -0.93 . . . . 0.0 111.211 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.76 -95.21 0.14 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.356 -2.298 . . . . 0.0 107.356 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.6 mmt-85 -113.4 150.25 32.97 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.4 p -144.71 126.41 15.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.971 -1.081 . . . . 0.0 111.509 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.34 146.74 5.87 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.8 m -118.48 146.63 44.35 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.761 0.791 . . . . 0.0 108.934 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.737 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.17 -129.39 0.26 Allowed 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 121.604 0.716 . . . . 0.0 109.352 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.564 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.8 mtt -65.97 26.42 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.737 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.42 -9.04 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 -178.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.1 mtmt -82.17 162.73 22.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt -105.62 174.52 5.85 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -161.21 136.25 7.52 Favored 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.969 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -55.49 114.7 7.74 Favored Pre-proline 0 C--N 1.301 -1.531 0 N-CA-C 105.525 -2.028 . . . . 0.0 105.525 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.605 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 45.2 Cg_exo -45.67 -12.84 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.527 0 CA-C-N 120.237 1.12 . . . . 0.0 111.408 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.855 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.0 mt-10 -95.73 -52.71 3.98 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.988 0.899 . . . . 0.0 110.252 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.519 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.2 m170 -58.35 -4.0 0.33 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.986 -1.071 . . . . 0.0 109.876 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.448 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.4 t80 -128.93 56.35 1.68 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 178.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.855 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.0 178.02 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.814 0.816 . . . . 0.0 110.898 -178.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.648 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.41 143.82 30.03 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.74 73.61 5.79 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.505 -2.078 . . . . 0.0 108.905 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . 0.447 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 34.9 t80 -154.56 -60.13 0.12 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 102.858 -3.016 . . . . 0.0 102.858 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' B' ' 580' ' ' LYS . 31.9 p -113.96 79.12 1.21 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.534 -2.121 . . . . 0.0 105.413 176.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 0.452 HD23 ' N ' ' B' ' 579' ' ' LEU . 5.9 mt -51.36 14.7 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.019 -0.992 . . . . 0.0 113.272 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -97.11 -36.84 10.35 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.045 -1.66 . . . . 0.0 112.652 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.605 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.18 140.93 13.38 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 119.617 -1.927 . . . . 0.0 114.636 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.648 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.2 tp -134.51 169.97 16.47 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.427 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.5 m-20 -145.49 128.16 16.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.335 -0.853 . . . . 0.0 109.073 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -51.2 -21.53 2.09 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.57 -0.707 . . . . 0.0 109.689 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.12 -19.81 60.25 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.56 28.46 3.97 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.569 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.07 105.72 17.97 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 122.932 1.349 . . . . 0.0 110.088 -179.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.528 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -97.51 167.76 10.79 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.5 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.8 tt0 -152.61 157.37 40.9 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.558 1.17 . . . . 0.0 110.711 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.629 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.9 OUTLIER -155.35 146.04 22.23 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 178.773 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.578 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 45.86 23.51 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.012 -1.055 . . . . 0.0 109.991 -179.701 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.68 -5.11 1.55 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.715 -0.615 . . . . 0.0 111.078 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 32.6 mttm -89.61 123.17 67.26 Favored Pre-proline 0 C--N 1.295 -1.8 0 O-C-N 121.161 -0.962 . . . . 0.0 109.241 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.486 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.8 Cg_exo -48.63 163.94 0.25 Allowed 'Trans proline' 0 N--CA 1.489 1.243 0 CA-C-N 120.051 1.054 . . . . 0.0 111.941 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' B' ' 588' ' ' LYS . 11.3 m-85 -170.34 138.43 1.58 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.017 -1.052 . . . . 0.0 110.685 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 39.5 m -75.38 157.39 34.27 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 174.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.605 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.03 -56.69 18.01 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 117.53 -1.668 . . . . 0.0 106.618 178.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.17 -27.29 0.94 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.582 -0.698 . . . . 0.0 109.552 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 87.9 m -85.06 -59.28 2.38 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.484 -0.76 . . . . 0.0 109.01 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -54.69 -49.48 70.56 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.706 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -55.73 -40.27 72.25 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.463 ' HD2' HG21 ' A' ' 75' ' ' THR . 0.2 OUTLIER -51.14 -28.32 10.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.756 . . . . 0.0 109.52 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.666 HD13 HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -94.08 -57.48 2.52 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.233 -0.917 . . . . 0.0 112.051 -176.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.629 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 14.6 m-85 -92.23 22.12 4.69 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.809 -1.182 . . . . 0.0 110.598 -178.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.52 ' O ' ' CE1' ' A' ' 76' ' ' HIS . 2.2 m . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.109 -0.995 . . . . 0.0 108.952 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.441 0 N-CA-C 108.648 -1.781 . . . . 0.0 108.648 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 p -97.91 122.07 40.58 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.661 -0.905 . . . . 0.0 109.771 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -127.92 130.11 47.94 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.484 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.612 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -82.98 135.72 34.78 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.189 -0.944 . . . . 0.0 110.013 -179.358 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.48 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.72 131.33 34.58 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.98 144.55 36.65 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 120.9 -1.125 . . . . 0.0 108.326 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.8 t -139.18 108.58 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.749 0.785 . . . . 0.0 110.314 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 14.0 m80 -82.49 105.98 13.99 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.537 ' O ' ' N ' ' A' ' 28' ' ' ASN . 5.4 t -73.45 111.18 7.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 118.807 -1.157 . . . . 0.0 109.607 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.487 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.1 p -76.87 165.58 24.5 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.8 t70 72.81 -44.57 0.6 Allowed 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.506 HD22 ' HD2' ' A' ' 29' ' ' ARG . 5.7 mt -94.25 -31.37 14.12 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 70.93 17.6 6.25 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.804 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.506 ' HD2' HD22 ' A' ' 27' ' ' LEU . 1.0 OUTLIER -89.13 -179.59 5.93 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.698 -1.251 . . . . 0.0 108.872 179.54 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 3.1 m-20 -139.91 115.41 9.99 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 17.3 t -115.25 157.41 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 CA-C-O 121.536 0.684 . . . . 0.0 109.966 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.483 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 132.76 42.03 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.483 HD22 ' C ' ' A' ' 32' ' ' THR . 3.7 mm? -115.53 112.91 22.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.636 -0.665 . . . . 0.0 110.372 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.65 109.1 0.95 Allowed 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.53 -169.27 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 CA-C-O 121.815 0.817 . . . . 0.0 110.218 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.7 p -143.64 174.55 10.69 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.73 44.01 3.04 Favored Glycine 0 N--CA 1.483 1.801 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.452 ' C ' HG21 ' A' ' 78' ' ' THR . 4.2 pt-20 -145.37 3.82 1.02 Allowed 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.592 ' O ' HG22 ' A' ' 78' ' ' THR . 2.4 m -89.16 143.3 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 120.92 -1.113 . . . . 0.0 110.072 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.511 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -80.16 141.83 35.33 Favored 'General case' 0 C--N 1.293 -1.881 0 O-C-N 120.888 -1.133 . . . . 0.0 108.126 178.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.464 ' C ' ' N ' ' A' ' 43' ' ' GLY . 19.6 mt -47.27 -58.32 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.047 -1.033 . . . . 0.0 109.495 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.406 ' H ' HG23 ' A' ' 75' ' ' THR . . . -54.38 -13.59 4.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.023 -2.031 . . . . 0.0 108.023 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.6 -28.47 67.36 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.95 -35.58 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.7 mtm -51.02 -37.72 46.91 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.606 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -70.32 -63.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.836 -0.54 . . . . 0.0 109.843 -179.192 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.429 ' HB2' HD12 ' A' ' 33' ' ' LEU . 32.8 mttt -53.34 -56.54 15.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.942 . . . . 0.0 111.37 -178.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.466 HD21 ' CD2' ' A' ' 92' ' ' PHE . 53.6 tp -45.46 -34.15 3.03 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.846 -1.159 . . . . 0.0 110.215 -177.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 19.4 t -80.46 -44.12 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.985 -1.072 . . . . 0.0 109.114 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -43.11 -33.89 0.96 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.527 0.679 . . . . 0.0 109.969 -178.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mtmt -83.72 -39.76 19.73 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.539 -0.726 . . . . 0.0 110.43 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.431 HD23 ' CG1' ' A' ' 54' ' ' VAL . 10.9 tp -51.23 -60.58 2.96 Favored 'General case' 0 N--CA 1.484 1.249 0 O-C-N 121.133 -0.979 . . . . 0.0 108.969 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 68.73 78.83 0.22 Allowed 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.861 0.838 . . . . 0.0 110.424 178.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.514 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -173.78 142.07 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.463 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.1 tttt -71.28 39.81 0.06 Allowed 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.554 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.7 ttmm -77.47 154.15 32.84 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.53 91.2 7.36 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 0.1 OUTLIER -80.59 -44.17 19.39 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 122.129 0.966 . . . . 0.0 109.015 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.499 ' C ' ' H ' ' A' ' 61' ' ' HIS . 58.4 p -39.82 -55.31 1.99 Allowed 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.166 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -52.41 -8.05 0.07 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.191 -0.943 . . . . 0.0 109.517 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.7 OUTLIER -98.27 173.32 7.05 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 122.319 1.057 . . . . 0.0 110.771 -179.233 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' CD2' ' A' ' 61' ' ' HIS . . . -168.19 162.18 12.73 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.822 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.4 mm? -94.75 145.9 24.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.182 -0.949 . . . . 0.0 109.347 -179.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.478 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.11 148.53 50.58 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -106.08 91.07 3.57 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.056 -1.027 . . . . 0.0 108.527 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.406 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.1 pt-20 -55.64 -21.77 19.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.064 -1.023 . . . . 0.0 111.037 -178.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.499 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -66.07 -17.73 64.89 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -125.97 -11.92 6.49 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.623 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.0 mpp_? 53.69 46.41 25.97 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 -177.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -113.03 -171.62 1.9 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.365 0.602 . . . . 0.0 109.851 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.552 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.34 99.46 5.43 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.496 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -60.36 82.28 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.926 0 CA-C-O 122.372 1.082 . . . . 0.0 110.673 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -118.33 5.74 11.86 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.414 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.48 55.54 2.32 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.539 HG21 ' O ' ' B' ' 602' ' ' LYS . 12.6 m -47.77 -25.06 1.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.047 -1.033 . . . . 0.0 109.218 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.1 158.32 13.99 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.487 -0.758 . . . . 0.0 109.461 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 45.1 m95 57.34 -138.16 0.94 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.662 -0.649 . . . . 0.0 110.05 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.592 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -155.63 -162.8 1.38 Allowed 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.527 -1.269 . . . . 0.0 111.583 -179.055 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.609 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.6 mp -72.46 -56.34 5.57 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -43.02 -49.41 6.07 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.629 -1.168 . . . . 0.0 111.188 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.54 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -56.63 -30.6 63.47 Favored 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.475 -178.3 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.54 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -82.88 -49.0 10.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.848 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 118.11 7.83 11.05 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.161 -1.976 . . . . 0.0 108.161 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.544 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 30.3 mt -60.66 161.36 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.544 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -155.75 -163.06 1.42 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.962 -1.086 . . . . 0.0 109.64 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.88 -24.18 59.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.49 -0.756 . . . . 0.0 110.75 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -84.77 3.17 38.81 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.43 -0.794 . . . . 0.0 109.756 -178.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.48 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -91.72 112.68 24.7 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.543 -0.723 . . . . 0.0 109.332 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -97.78 117.87 33.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.92 -1.113 . . . . 0.0 109.894 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.419 ' HG ' HD12 ' A' ' 20' ' ' LEU . 2.5 mt -103.6 178.01 4.68 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.478 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.7 mt-30 -131.52 157.92 42.28 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -122.79 93.4 3.95 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.817 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.229 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.361 -178.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.538 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.26 136.17 57.95 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.627 -1.296 . . . . 0.0 110.474 -178.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.512 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.4 OUTLIER -83.89 103.51 13.22 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 178.094 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.4 t -52.11 128.83 25.89 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 122.315 1.055 . . . . 0.0 110.872 -176.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.71 -25.43 28.34 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 106.433 -2.667 . . . . 0.0 106.433 -178.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . 0.478 ' HB2' ' SG ' ' B' ' 549' ' ' CYS . 2.0 t -112.78 -29.99 7.22 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' B' ' 549' ' ' CYS . 17.3 mm-40 46.88 57.46 5.61 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 122.525 1.155 . . . . 0.0 112.779 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -142.51 125.92 9.47 Favored Pre-proline 0 C--N 1.286 -2.184 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -44.34 134.94 9.05 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 CA-C-N 120.412 1.183 . . . . 0.0 114.596 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.4 mt -94.37 98.04 7.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 5.3 p -100.54 90.94 4.45 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.273 -0.892 . . . . 0.0 111.194 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.11 -96.33 0.16 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.483 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.0 mmt-85 -110.83 150.54 29.0 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 178.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.73 126.26 15.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 111.677 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.27 146.49 6.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 178.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.434 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 8.9 m -119.93 146.45 45.79 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.803 0.811 . . . . 0.0 109.02 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.21 -129.29 0.27 Allowed 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.517 0.675 . . . . 0.0 109.538 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.56 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 13.7 mtm -66.09 26.57 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.62 -9.38 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . 0.451 ' NZ ' ' CE ' ' B' ' 564' ' ' MET . 13.1 mtmt -81.53 161.14 23.7 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -103.29 174.4 5.88 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.11 134.9 7.74 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.207 -1.397 . . . . 0.0 109.911 -179.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.556 ' O ' ' N ' ' B' ' 571' ' ' GLU . 4.4 m80 -55.84 114.9 8.28 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 176.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.601 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.22 -12.49 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.534 0 CA-C-N 120.47 1.204 . . . . 0.0 110.703 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.844 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.5 mt-10 -94.57 -52.46 4.3 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.046 0.927 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.534 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -60.67 -3.67 0.77 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.958 -1.089 . . . . 0.0 109.812 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.414 ' H ' ' C ' ' B' ' 571' ' ' GLU . 25.5 t80 -128.84 55.78 1.7 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.844 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.4 m -94.52 178.2 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-O 121.85 0.833 . . . . 0.0 111.24 -178.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.658 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.8 142.59 30.54 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.76 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -92.6 75.22 5.07 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 116.717 -1.993 . . . . 0.0 109.289 178.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -153.05 -51.58 0.1 Allowed 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 102.413 -3.18 . . . . 0.0 102.413 173.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.553 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.1 p -129.64 80.53 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.94 -2.391 . . . . 0.0 105.299 177.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.85 15.1 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -176.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.553 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.99 -37.22 16.54 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 119.733 -1.854 . . . . 0.0 112.112 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.601 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -160.13 139.82 11.23 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 119.624 -1.923 . . . . 0.0 114.907 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.8 tp -135.81 169.35 17.7 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 71.2 m-20 -142.53 143.34 32.46 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.333 -0.855 . . . . 0.0 108.891 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.434 ' HE3' ' H ' ' B' ' 562' ' ' THR . 11.4 ptpt -64.14 -17.24 63.28 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.478 -0.763 . . . . 0.0 109.773 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.59 -17.14 55.56 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.08 27.14 4.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.933 -0.745 . . . . 0.0 109.363 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.517 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -88.72 111.24 21.74 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.593 1.187 . . . . 0.0 109.331 179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.514 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.76 168.89 8.95 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.8 tt0 -151.84 157.07 41.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.729 -1.232 . . . . 0.0 110.797 -178.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.539 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 2.5 tp60 -158.59 146.45 18.12 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 178.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.622 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.24 22.56 0.45 Allowed 'General case' 0 C--N 1.295 -1.783 0 O-C-N 120.911 -1.118 . . . . 0.0 109.547 -179.434 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 0.8 OUTLIER 79.44 -3.69 2.08 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.732 -0.605 . . . . 0.0 110.933 178.519 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -91.03 125.44 58.74 Favored Pre-proline 0 C--N 1.294 -1.81 0 O-C-N 121.265 -0.897 . . . . 0.0 109.39 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.6 Cg_exo -48.87 165.77 0.17 Allowed 'Trans proline' 0 N--CA 1.492 1.404 0 CA-C-N 120.15 1.089 . . . . 0.0 111.955 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.0 m-85 -171.1 136.89 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.9 -1.125 . . . . 0.0 111.066 -178.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 23.3 m -73.05 154.55 40.4 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.564 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.77 -58.14 9.85 Favored 'General case' 0 C--N 1.288 -2.081 0 C-N-CA 117.525 -1.67 . . . . 0.0 106.582 179.28 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -46.04 -26.17 0.69 Allowed 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -85.36 -64.48 1.15 Allowed 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.533 -0.73 . . . . 0.0 109.389 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -50.98 -53.56 32.06 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.847 . . . . 0.0 108.856 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.719 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -50.51 -41.87 54.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.539 ' O ' HG21 ' A' ' 75' ' ' THR . 0.2 OUTLIER -53.38 -24.42 12.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.452 -0.78 . . . . 0.0 109.087 179.558 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.606 HD13 HD12 ' A' ' 46' ' ' LEU . 3.6 mt -94.16 -56.97 2.66 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.281 -0.887 . . . . 0.0 111.5 -178.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.515 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 51.7 m-85 -105.1 -28.49 10.98 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.136 -0.978 . . . . 0.0 110.953 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.2 p . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.949 -179.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.574 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -76.92 126.55 31.16 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.416 -1.05 . . . . 0.0 110.379 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.4 ' CD2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -130.68 119.76 22.88 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 177.89 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.9 127.83 33.9 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.11 -1.036 . . . . 0.0 109.008 -179.375 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.54 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -83.52 134.3 34.84 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 179.447 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 t -78.21 145.68 35.4 Favored 'General case' 0 C--N 1.294 -1.822 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.433 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.5 t -136.81 105.3 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 CA-C-O 121.817 0.817 . . . . 0.0 109.525 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.53 ' CD2' ' OD2' ' A' ' 30' ' ' ASP . 12.1 m80 -78.79 103.71 8.92 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 178.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.5 t -72.28 113.3 9.23 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 118.613 -1.235 . . . . 0.0 107.972 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.477 ' C ' ' H ' ' A' ' 27' ' ' LEU . 30.3 p -80.84 -36.94 30.83 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.392 -0.817 . . . . 0.0 109.873 -178.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -71.34 9.55 0.77 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.946 -1.096 . . . . 0.0 108.654 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.9 mt -147.06 -29.07 0.37 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.585 -0.697 . . . . 0.0 109.294 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 80.78 12.5 0.84 Allowed 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -179.424 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -94.29 -178.26 4.54 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.997 -1.065 . . . . 0.0 109.495 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.53 ' OD2' ' CD2' ' A' ' 23' ' ' HIS . 3.5 m-20 -136.0 114.99 12.24 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 25.8 t -112.35 157.59 13.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.493 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -132.46 133.99 44.53 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.493 HD22 ' C ' ' A' ' 32' ' ' THR . 3.6 mm? -113.76 113.01 24.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.645 -0.659 . . . . 0.0 109.695 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.574 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 14.7 tpt180 -60.12 102.38 0.16 Allowed 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 23.8 m -132.96 -169.75 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 CA-C-O 121.918 0.866 . . . . 0.0 110.854 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.3 p -145.26 176.43 9.55 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.33 46.58 3.04 Favored Glycine 0 C--N 1.295 -1.729 0 N-CA-C 109.153 -1.579 . . . . 0.0 109.153 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.439 ' C ' HG21 ' A' ' 78' ' ' THR . 4.2 pt-20 -147.01 0.23 0.72 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.203 -1.175 . . . . 0.0 108.669 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 m -89.76 128.21 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 120.97 -1.081 . . . . 0.0 109.691 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 43' ' ' GLY . 7.6 m80 -66.92 144.15 56.41 Favored 'General case' 0 C--N 1.291 -1.957 0 O-C-N 121.001 -1.062 . . . . 0.0 108.887 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.519 HD13 ' HB3' ' A' ' 72' ' ' LEU . 96.4 mt -46.22 -56.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.194 -0.941 . . . . 0.0 109.365 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.591 ' H ' HG23 ' A' ' 75' ' ' THR . . . -57.24 -14.86 13.0 Favored Glycine 0 C--N 1.296 -1.661 0 N-CA-C 108.741 -1.744 . . . . 0.0 108.741 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.29 -18.69 77.86 Favored Glycine 0 N--CA 1.485 1.905 0 N-CA-C 109.131 -1.588 . . . . 0.0 109.131 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 t -83.41 -50.76 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.385 -1.068 . . . . 0.0 109.063 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.6 mtm -50.41 -39.66 47.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.867 -1.145 . . . . 0.0 108.542 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.704 HD12 HD13 ' B' ' 603' ' ' LEU . 6.7 tt -56.98 -53.87 53.19 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.41 ' CB ' HD12 ' A' ' 33' ' ' LEU . 55.1 mttm -67.27 -52.84 35.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.12 -0.988 . . . . 0.0 110.7 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.1 tp -44.77 -40.48 6.11 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.142 -0.974 . . . . 0.0 110.163 -178.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.5 t -78.07 -45.68 27.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.927 -1.108 . . . . 0.0 109.952 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -44.67 -37.43 3.67 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.349 -0.844 . . . . 0.0 109.831 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.523 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.8 mtmp? -75.87 -39.04 57.25 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.46 -0.775 . . . . 0.0 110.775 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.442 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -62.03 -67.56 0.4 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.039 -1.038 . . . . 0.0 109.089 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.76 80.83 0.1 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.97 0.891 . . . . 0.0 110.142 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.497 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.3 p -172.52 142.06 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -68.04 31.83 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.0 110.833 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.497 ' H ' ' C ' ' A' ' 54' ' ' VAL . 1.6 tppp? -79.86 142.15 35.49 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.859 -1.151 . . . . 0.0 108.268 178.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -60.0 115.77 3.67 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.477 -0.765 . . . . 0.0 110.03 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.424 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 71.2 m95 -119.67 -43.79 2.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.569 -0.707 . . . . 0.0 109.788 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -48.67 -56.04 9.63 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.954 -1.091 . . . . 0.0 110.094 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.62 -36.84 47.46 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.133 -0.979 . . . . 0.0 108.904 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.408 ' O ' ' CZ ' ' A' ' 92' ' ' PHE . 14.7 m170 -72.49 128.02 34.34 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.888 0.851 . . . . 0.0 110.586 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.68 160.11 27.89 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.496 ' HA ' ' O ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER -99.7 148.63 24.16 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-O 122.274 1.035 . . . . 0.0 110.031 -178.65 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.47 ' CD1' ' C ' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.07 151.28 48.83 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.191 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.647 ' HB2' HD21 ' A' ' 72' ' ' LEU . 5.2 t90 -100.73 90.5 4.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.8 -1.188 . . . . 0.0 108.674 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.416 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 9.2 pt-20 -54.59 -23.17 15.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.17 -0.956 . . . . 0.0 110.91 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.504 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 15.7 mmtp -67.48 -10.7 53.97 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -133.93 -11.48 2.62 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.1 mpp_? 52.92 45.92 27.81 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 5.0 t -111.81 -169.91 1.55 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.282 0.563 . . . . 0.0 109.933 -178.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.489 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -128.24 103.9 7.44 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 177.707 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 65' ' ' TRP . 10.1 mt -63.23 82.57 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.468 0 O-C-N 120.479 -1.388 . . . . 0.0 110.318 -176.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.2 pp -113.59 15.19 18.98 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HZ1' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -84.22 61.11 6.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.647 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.591 HG23 ' H ' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -75.12 -5.86 46.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.066 -1.021 . . . . 0.0 109.419 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.423 ' ND1' ' N ' ' A' ' 76' ' ' HIS . 6.4 m80 -68.79 -53.04 23.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.338 -0.852 . . . . 0.0 110.782 -179.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -97.24 -128.31 0.16 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -153.33 150.79 29.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.411 -1.431 . . . . 0.0 108.867 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.678 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -40.1 -49.32 2.58 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.504 -0.748 . . . . 0.0 111.224 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.452 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 23.0 t70 -46.91 -34.78 5.76 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.187 -0.945 . . . . 0.0 109.413 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.492 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -66.77 -30.44 70.65 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.534 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -79.31 -51.66 9.14 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.048 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.6 9.9 5.66 Favored Glycine 0 N--CA 1.51 3.598 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 53.2 mt -60.87 161.86 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 O-C-N 122.2 -0.588 . . . . 0.0 109.446 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -162.53 -159.02 0.54 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.255 -0.903 . . . . 0.0 109.279 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.68 -26.05 60.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.329 -0.857 . . . . 0.0 109.732 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -79.83 -1.81 40.64 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.111 -179.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.5 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.35 113.48 25.82 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.523 -0.736 . . . . 0.0 109.059 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -98.05 115.43 28.21 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.897 -1.127 . . . . 0.0 110.255 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.54 ' HG ' HD12 ' A' ' 20' ' ' LEU . 8.1 mt -91.54 176.29 6.6 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.496 ' O ' ' HA ' ' A' ' 63' ' ' LEU . 2.6 mt-30 -142.27 148.24 37.75 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.408 ' CZ ' ' O ' ' A' ' 61' ' ' HIS . 10.0 t80 -111.34 90.88 3.46 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.235 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.531 -178.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.27 136.71 58.12 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.887 -1.133 . . . . 0.0 110.527 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.553 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.1 OUTLIER -83.72 102.86 12.57 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 105.571 -2.011 . . . . 0.0 105.571 178.358 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.21 127.5 14.86 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.175 0.988 . . . . 0.0 110.654 -177.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.57 -26.2 25.47 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 106.788 -2.525 . . . . 0.0 106.788 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . 0.432 ' CB ' ' SG ' ' B' ' 549' ' ' CYS . 6.4 t -110.51 -30.93 7.43 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.2 mm-40 47.46 57.04 6.24 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-O 122.711 1.243 . . . . 0.0 112.02 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 37.3 mmtm -142.44 125.58 9.38 Favored Pre-proline 0 C--N 1.287 -2.135 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -44.03 136.41 7.62 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.415 1.184 . . . . 0.0 114.582 -178.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.553 HD11 ' HA ' ' B' ' 549' ' ' CYS . 43.8 mt -94.9 98.41 7.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 3.6 p -99.48 91.01 4.71 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.998 0.904 . . . . 0.0 111.179 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.06 -96.82 0.16 Allowed Glycine 0 N--CA 1.488 2.126 0 N-CA-C 107.675 -2.17 . . . . 0.0 107.675 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.12 153.31 28.42 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 20.7 p -144.09 126.5 15.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.014 -1.054 . . . . 0.0 111.558 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 51.6 mt -90.03 145.52 7.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.472 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 9.8 m -121.95 146.38 47.2 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-O 121.965 0.888 . . . . 0.0 109.193 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.742 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.34 -128.85 0.26 Allowed 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.8 mtt -65.44 25.63 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.593 -0.692 . . . . 0.0 109.255 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.742 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.07 -8.66 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 -178.082 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.57 148.94 28.87 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -95.13 174.19 7.19 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -159.95 132.05 6.3 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 118.56 -1.256 . . . . 0.0 109.81 -179.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.569 ' O ' ' N ' ' B' ' 571' ' ' GLU . 1.4 m80 -54.56 117.83 14.74 Favored Pre-proline 0 C--N 1.299 -1.593 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 176.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.585 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.1 Cg_exo -48.6 -9.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.303 -1.828 0 CA-C-N 120.48 1.207 . . . . 0.0 110.272 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.899 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.0 mt-10 -97.58 -52.85 3.63 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.62 0.724 . . . . 0.0 110.56 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -59.96 -2.72 0.44 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.612 -1.305 . . . . 0.0 109.685 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.445 ' H ' ' C ' ' B' ' 571' ' ' GLU . 5.8 t80 -128.06 56.6 1.59 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 178.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.899 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.0 m -95.1 177.82 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 CA-C-O 121.718 0.77 . . . . 0.0 111.5 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.619 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.87 145.86 30.15 Favored 'General case' 0 N--CA 1.505 2.303 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.72 76.33 3.22 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 116.915 -1.914 . . . . 0.0 109.949 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -152.57 -60.53 0.15 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 101.252 -3.61 . . . . 0.0 101.252 173.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 21.5 p -121.04 81.51 1.79 Allowed 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 111.659 -2.518 . . . . 0.0 104.803 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 0.461 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.9 mp -53.62 16.88 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -176.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.0 -36.9 19.49 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.585 -1.947 . . . . 0.0 112.522 -178.613 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.585 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.27 140.09 12.57 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 119.465 -2.022 . . . . 0.0 115.073 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.619 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.3 tp -139.99 170.48 15.78 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 175.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.5 m-20 -149.38 134.55 18.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.101 -1.0 . . . . 0.0 109.098 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.472 ' CE ' ' O ' ' B' ' 562' ' ' THR . 12.3 ptpt -51.91 -19.37 1.73 Allowed 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.456 -0.778 . . . . 0.0 109.634 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -18.26 55.73 Favored Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -134.05 25.41 3.91 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.557 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.3 109.01 20.12 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 122.5 1.143 . . . . 0.0 110.232 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -104.58 169.0 8.72 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.3 tt0 -152.38 157.23 40.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.678 -1.264 . . . . 0.0 110.781 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.502 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 2.8 tp60 -155.0 146.44 23.06 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 178.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.535 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.56 23.65 0.15 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.997 -1.064 . . . . 0.0 109.909 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 82.49 -5.95 1.35 Allowed 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.816 -0.553 . . . . 0.0 110.768 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -90.27 118.91 69.18 Favored Pre-proline 0 C--N 1.295 -1.78 0 O-C-N 121.158 -0.964 . . . . 0.0 109.652 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.522 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 38.2 Cg_exo -49.27 164.98 0.25 Allowed 'Trans proline' 0 N--CA 1.491 1.335 0 CA-C-N 119.996 1.034 . . . . 0.0 112.288 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.522 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 22.5 m-85 -170.8 139.58 1.52 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.224 -0.923 . . . . 0.0 109.866 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.1 m -70.02 154.63 41.7 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.545 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.08 -55.53 33.79 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 179.183 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.98 -29.32 4.68 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.41 -58.47 3.11 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.613 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -60.27 -59.48 5.35 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.81 -0.556 . . . . 0.0 110.246 -179.764 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.71 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.55 -38.7 9.79 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.366 -0.834 . . . . 0.0 109.36 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.531 ' O ' HG21 ' A' ' 75' ' ' THR . 17.4 tptm -63.19 -20.71 65.66 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.542 -0.724 . . . . 0.0 110.855 -179.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.704 HD13 HD12 ' A' ' 46' ' ' LEU . 3.0 mt -92.11 -57.3 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.75 -1.219 . . . . 0.0 111.239 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.49 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 10.5 m-85 -96.07 12.03 32.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.16 -0.963 . . . . 0.0 109.905 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.49 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 26.4 m . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.25 179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.351 0 N-CA-C 108.198 -1.961 . . . . 0.0 108.198 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.502 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 21.8 p -89.98 124.14 34.49 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.809 -0.818 . . . . 0.0 110.619 -178.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -119.0 122.15 41.52 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 177.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.626 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -79.37 128.78 33.76 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.106 -0.996 . . . . 0.0 109.975 -178.837 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.5 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.47 133.96 34.46 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.776 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.81 34.59 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -178.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.4 t -135.31 107.31 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 CA-C-O 121.802 0.81 . . . . 0.0 109.117 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -78.62 103.71 8.75 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -71.24 98.92 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 27' ' ' LEU . 19.7 p -68.19 -48.56 64.91 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.826 -0.546 . . . . 0.0 111.161 -177.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.91 12.22 0.23 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.753 -1.217 . . . . 0.0 109.698 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.498 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -141.36 -24.98 0.72 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 77.15 13.25 2.08 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 122.041 -0.412 . . . . 0.0 110.234 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.5 mtp-105 -96.92 -178.16 4.13 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 120.966 -1.084 . . . . 0.0 109.687 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -137.51 114.23 10.47 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.435 HG12 ' N ' ' A' ' 32' ' ' THR . 30.3 t -110.65 157.65 11.35 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.593 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -131.72 135.3 46.73 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.495 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.594 HD22 ' N ' ' A' ' 33' ' ' LEU . 3.8 mm? -109.15 110.44 21.67 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.685 -0.634 . . . . 0.0 109.416 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.502 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.9 tpt180 -60.87 101.73 0.16 Allowed 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.7 m -133.55 -169.63 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-O 122.187 0.994 . . . . 0.0 110.742 -178.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.7 p -142.4 174.51 10.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.26 45.51 3.04 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.442 ' C ' HG21 ' A' ' 78' ' ' THR . 1.4 pp20? -146.61 4.87 0.9 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.595 -0.944 . . . . 0.0 108.948 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.596 ' O ' HG22 ' A' ' 78' ' ' THR . 2.5 m -89.83 138.28 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.122 -0.986 . . . . 0.0 110.335 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.487 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.1 m-70 -82.0 146.12 29.88 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.025 -1.047 . . . . 0.0 108.585 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 73.7 mt -47.36 -56.5 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.953 -1.092 . . . . 0.0 109.896 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.02 -14.89 4.57 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.378 -1.889 . . . . 0.0 108.378 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.487 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.08 -27.49 58.06 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 108.511 -1.835 . . . . 0.0 108.511 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.405 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.18 -39.32 19.15 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.433 ' O ' HG23 ' A' ' 49' ' ' VAL . 38.6 mtm -51.39 -40.05 58.44 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -62.95 -58.41 7.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.623 -0.673 . . . . 0.0 109.931 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.492 ' HB2' HD12 ' A' ' 33' ' ' LEU . 54.7 mttm -54.95 -59.75 4.31 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.425 -0.797 . . . . 0.0 111.234 -178.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.7 tp -45.51 -38.26 6.13 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.958 -1.089 . . . . 0.0 109.716 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.714 HG22 ' CD2' ' A' ' 58' ' ' TRP . 54.0 t -70.24 -53.93 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -45.34 -47.25 13.32 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.188 0.518 . . . . 0.0 110.975 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.593 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 7.3 mtmp? -60.85 -58.06 10.06 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.229 -0.919 . . . . 0.0 110.634 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.6 tp -55.52 -49.99 71.15 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 t70 66.05 74.96 0.35 Allowed 'General case' 0 C--N 1.299 -1.617 0 CA-C-O 121.805 0.812 . . . . 0.0 109.989 178.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.428 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.31 144.68 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.999 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.979 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' CB ' ' B' ' 576' ' ' ALA . 20.6 mmtt -71.84 45.29 0.11 Allowed 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.535 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 40.8 tttm -76.26 171.18 14.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.415 -0.803 . . . . 0.0 110.429 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 8.4 m-20 -50.89 91.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.366 -0.833 . . . . 0.0 110.357 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.714 ' CD2' HG22 ' A' ' 49' ' ' VAL . 67.7 m95 -113.55 -13.51 12.76 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 122.282 1.039 . . . . 0.0 109.102 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.6 t -57.39 -54.11 50.47 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-O 121.778 0.799 . . . . 0.0 109.787 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.432 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 54.5 t0 -91.26 12.56 19.86 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.76 -0.588 . . . . 0.0 110.684 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.46 134.77 48.09 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.124 -0.985 . . . . 0.0 110.023 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.74 148.52 4.36 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.3 mm? -95.6 148.35 22.61 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.859 -1.151 . . . . 0.0 110.611 -178.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.528 ' HE1' ' CA ' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -129.94 137.65 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -99.7 91.67 4.97 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.528 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 16.5 pt-20 -57.51 -22.01 41.53 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.965 -1.084 . . . . 0.0 110.553 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.494 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -62.95 -13.38 34.05 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 177.762 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.444 ' N ' ' C ' ' A' ' 66' ' ' GLU . 18.9 mmtt -130.85 -12.8 3.71 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.477 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.4 mpp_? 54.11 45.9 26.52 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 -177.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.61 -175.42 2.67 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.647 0.737 . . . . 0.0 109.957 -178.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.467 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.67 102.35 7.3 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 177.655 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' A' ' 41' ' ' ILE . 28.8 mt -62.01 87.01 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.262 0 O-C-N 120.431 -1.418 . . . . 0.0 110.433 -176.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.7 pp -124.52 10.91 8.54 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 82.61 7.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.209 -0.932 . . . . 0.0 108.895 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.417 HG21 ' O ' ' B' ' 602' ' ' LYS . 0.2 OUTLIER -75.47 -12.06 60.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.095 -1.003 . . . . 0.0 109.984 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.742 ' H ' ' CD2' ' A' ' 76' ' ' HIS . 0.6 OUTLIER -90.78 44.07 1.18 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.866 -1.147 . . . . 0.0 109.468 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.521 ' CG ' ' O ' ' A' ' 76' ' ' HIS . 1.3 m0 -173.42 -169.87 0.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.698 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -139.97 -169.19 2.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.898 -1.126 . . . . 0.0 109.692 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.533 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.8 mp -65.25 -60.0 3.47 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -45.68 -52.83 10.24 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.857 0.837 . . . . 0.0 109.804 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.698 ' CG ' ' H ' ' A' ' 78' ' ' THR . 36.7 mmtt -45.43 -55.96 5.53 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.639 0.733 . . . . 0.0 109.731 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -41.73 69.63 Favored 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 119.827 -0.749 . . . . 0.0 109.155 -179.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.3 11.53 6.73 Favored Glycine 0 N--CA 1.5 2.908 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 43.1 mt -71.23 160.71 5.08 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.606 -0.937 . . . . 0.0 109.513 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.76 -165.15 0.42 Allowed 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.94 -22.23 62.25 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.417 -0.802 . . . . 0.0 110.098 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -79.93 -10.0 59.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.157 -0.964 . . . . 0.0 108.844 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.468 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.93 112.83 25.09 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.9 115.59 27.97 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 109.964 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.5 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.4 mt -90.12 176.22 6.85 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.466 ' NE2' ' CZ2' ' A' ' 64' ' ' TRP . 1.2 mt-30 -140.63 148.93 41.64 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.1 OUTLIER -96.0 142.52 28.11 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.1 t . . . . . 0 N--CA 1.496 1.846 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 179.449 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.3 mp -59.38 135.56 57.69 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.888 -1.133 . . . . 0.0 110.653 -178.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.499 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.89 103.97 13.59 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.267 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 18.3 t -51.65 127.21 19.83 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.201 1.001 . . . . 0.0 109.659 -177.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.74 -34.21 5.6 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.142 -2.783 . . . . 0.0 106.142 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.1 m -106.23 -36.2 6.95 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.465 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.0 mm-40 55.72 56.37 6.21 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 122.639 1.209 . . . . 0.0 109.942 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.7 mmtm -140.53 124.06 10.32 Favored Pre-proline 0 N--CA 1.496 1.851 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -44.2 135.17 8.58 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 120.492 1.211 . . . . 0.0 114.855 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.54 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.8 mt -94.04 99.3 9.31 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 80.9 p -100.82 91.7 4.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.307 -0.871 . . . . 0.0 111.238 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.96 -96.59 0.16 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 107.334 -2.306 . . . . 0.0 107.334 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.489 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.3 mmt-85 -112.12 152.9 27.75 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.4 p -145.18 126.13 14.5 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.978 -1.076 . . . . 0.0 111.577 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.8 mt -90.54 146.07 6.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 178.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.468 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 8.9 m -120.0 146.54 45.76 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 121.916 0.865 . . . . 0.0 109.283 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.723 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.19 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.803 0 CA-C-O 121.605 0.717 . . . . 0.0 109.406 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.548 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.1 mtt -65.66 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.688 0 O-C-N 121.617 -0.677 . . . . 0.0 109.272 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.723 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.46 -9.05 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.17 159.99 24.49 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -103.84 174.68 5.77 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -160.09 133.58 6.98 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.268 -1.373 . . . . 0.0 110.005 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.568 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -54.16 114.3 6.35 Favored Pre-proline 0 C--N 1.302 -1.49 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.554 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 36.8 Cg_exo -46.96 -9.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.422 0 CA-C-N 120.331 1.154 . . . . 0.0 111.535 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.877 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.9 mt-10 -98.69 -52.92 3.45 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.011 0.91 . . . . 0.0 110.008 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.559 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -56.91 -4.86 0.19 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.917 -1.114 . . . . 0.0 109.87 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . 0.466 ' H ' ' C ' ' B' ' 571' ' ' GLU . 30.1 t80 -125.47 53.7 1.53 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.877 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.9 m -93.1 178.26 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 122.17 0.986 . . . . 0.0 110.487 -178.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.627 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.42 150.93 28.14 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.21 -179.499 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . 0.568 ' CB ' ' NZ ' ' A' ' 55' ' ' LYS . . . -96.24 76.85 3.03 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 117.219 -1.792 . . . . 0.0 110.031 178.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . 0.433 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 27.9 t80 -152.65 -44.38 0.1 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 173.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.2 p -137.3 125.62 23.28 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 111.71 -2.495 . . . . 0.0 106.624 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.78 13.72 0.78 Allowed 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.055 -1.028 . . . . 0.0 111.84 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.449 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -91.93 -39.7 11.56 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-N 121.614 2.007 . . . . 0.0 115.204 -175.272 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.554 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.97 141.91 8.6 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 122.377 2.353 . . . . 0.0 116.09 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.627 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.9 tp -140.38 168.66 19.29 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 174.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 68.7 m-20 -147.67 134.98 20.62 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.066 -1.021 . . . . 0.0 109.163 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.468 ' CE ' ' O ' ' B' ' 562' ' ' THR . 11.3 ptpt -55.4 -14.13 1.77 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.73 0.776 . . . . 0.0 109.53 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -95.62 -14.97 45.04 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.6 p -136.41 26.79 3.14 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.94 -0.741 . . . . 0.0 109.083 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.575 ' HA ' HD11 ' B' ' 582' ' ' LEU . 2.8 p90 -88.25 109.39 19.9 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 122.32 1.057 . . . . 0.0 109.176 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.88 159.35 15.14 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.442 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.5 tt0 -155.24 157.25 37.0 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 122.699 1.237 . . . . 0.0 111.456 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.442 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 3.7 pt20 -160.9 146.19 14.33 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.702 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.32 22.97 1.54 Allowed 'General case' 0 C--N 1.287 -2.129 0 O-C-N 121.263 -0.898 . . . . 0.0 109.155 -178.572 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.57 -7.07 1.47 Allowed 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.775 -0.578 . . . . 0.0 111.819 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -87.83 116.12 65.18 Favored Pre-proline 0 C--N 1.294 -1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 110.643 -178.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 34.6 Cg_exo -53.05 164.31 1.75 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 CA-C-N 119.883 0.994 . . . . 0.0 112.147 178.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.0 m-85 -171.04 139.91 1.46 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.287 -0.883 . . . . 0.0 110.229 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.53 155.14 40.96 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 103.529 -2.767 . . . . 0.0 103.529 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.598 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.15 -55.91 28.95 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.062 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.35 -26.97 0.92 Allowed 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.682 -0.636 . . . . 0.0 109.455 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 23.2 m -84.8 -60.23 2.12 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.479 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.6 OUTLIER -55.76 -54.66 41.68 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.684 . . . . 0.0 109.273 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.652 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.71 -41.79 32.99 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.628 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.417 ' O ' HG21 ' A' ' 75' ' ' THR . 0.4 OUTLIER -52.78 -26.95 15.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 109.016 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.3 mt -92.68 -57.25 2.73 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.195 -0.941 . . . . 0.0 111.25 -177.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' O ' ' B' ' 605' ' ' CYS . 11.6 m-85 -102.08 32.13 3.62 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.318 -0.864 . . . . 0.0 110.022 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.409 ' O ' ' O ' ' B' ' 604' ' ' PHE . 9.5 t . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 117.923 -1.037 . . . . 0.0 109.713 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.492 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . . . . . . 0 N--CA 1.491 2.347 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 p -85.67 122.86 30.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.611 -0.934 . . . . 0.0 110.427 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.492 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -137.81 122.52 18.69 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.788 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.617 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.74 130.11 36.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.225 -0.922 . . . . 0.0 108.717 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.491 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.6 133.7 34.83 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.2 145.5 35.53 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.242 -0.911 . . . . 0.0 109.62 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.5 t -138.16 106.25 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-O 121.9 0.857 . . . . 0.0 109.683 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -80.62 103.71 10.66 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.577 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.2 t -72.41 103.48 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.516 ' O ' ' N ' ' A' ' 27' ' ' LEU . 4.1 p -69.03 -65.55 0.69 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 110.89 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' N ' ' OG1' ' A' ' 25' ' ' THR . 25.7 t70 -49.35 -9.25 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.047 -1.033 . . . . 0.0 110.393 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 25' ' ' THR . 2.2 mt -120.86 -23.76 5.83 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.383 -0.823 . . . . 0.0 108.941 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 74.27 13.92 3.82 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 122.143 -0.348 . . . . 0.0 110.406 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.425 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 56.6 mtp85 -97.25 -178.53 4.2 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.925 -1.11 . . . . 0.0 109.791 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 29' ' ' ARG . 83.7 m-20 -138.39 118.24 13.26 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 32' ' ' THR . 16.6 t -120.47 157.9 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.557 0.694 . . . . 0.0 109.629 -179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.445 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.11 136.63 45.94 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.445 HD22 ' C ' ' A' ' 32' ' ' THR . 3.2 mm? -114.46 113.04 23.94 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -60.28 101.97 0.15 Allowed 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 179.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.9 m -132.59 -174.9 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 CA-C-O 121.925 0.869 . . . . 0.0 110.316 -178.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 p -141.11 175.56 9.53 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.59 49.02 3.3 Favored Glycine 0 C--N 1.292 -1.882 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.406 ' HA ' HG21 ' A' ' 78' ' ' THR . 0.7 OUTLIER -145.72 -4.65 0.66 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.44 -1.036 . . . . 0.0 109.021 -179.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.531 ' O ' HG22 ' A' ' 78' ' ' THR . 1.2 m -87.5 150.29 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.162 -0.961 . . . . 0.0 110.455 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.3 138.72 31.31 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.517 HD13 ' HB3' ' A' ' 72' ' ' LEU . 38.7 mt -50.58 -49.03 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.953 -1.092 . . . . 0.0 108.499 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.509 ' H ' ' HB ' ' A' ' 75' ' ' THR . . . -53.49 -13.76 3.04 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 108.287 -1.925 . . . . 0.0 108.287 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.468 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -79.67 -38.56 20.08 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 108.155 -1.978 . . . . 0.0 108.155 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.61 -43.21 94.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.4 mtm -50.95 -32.78 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -77.94 -64.06 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.228 0.537 . . . . 0.0 109.939 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -51.63 -59.38 4.34 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.193 -0.942 . . . . 0.0 110.863 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.82 -55.25 5.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.151 -0.968 . . . . 0.0 108.78 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.412 HG13 ' CE2' ' A' ' 58' ' ' TRP . 14.2 t -56.81 -52.42 54.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 O-C-N 121.839 -0.538 . . . . 0.0 109.589 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -44.55 -40.51 5.75 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.204 -0.935 . . . . 0.0 110.159 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.471 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -71.66 -27.9 63.38 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.618 HD21 ' NZ ' ' A' ' 56' ' ' LYS . 7.2 tp -65.75 -58.63 5.21 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.186 -0.946 . . . . 0.0 109.031 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t0 69.17 72.06 0.26 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.765 0.793 . . . . 0.0 110.698 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.528 ' C ' ' H ' ' A' ' 56' ' ' LYS . 3.1 p -175.25 138.62 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.96 34.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.13 -0.981 . . . . 0.0 109.641 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.618 ' NZ ' HD21 ' A' ' 52' ' ' LEU . 6.6 ttpm? -78.03 168.81 19.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.041 -1.037 . . . . 0.0 109.469 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.457 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -50.17 109.36 0.29 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.455 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 44.3 m0 -103.83 -89.47 0.4 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 61' ' ' HIS . 4.9 t -43.6 -48.21 7.59 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.17 -0.956 . . . . 0.0 110.492 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' SER . 9.0 t0 -43.7 -19.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 1.6 p-80 -88.52 167.52 13.36 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 122.021 0.915 . . . . 0.0 109.821 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.54 153.12 4.97 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -94.07 147.16 23.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.973 -1.08 . . . . 0.0 109.288 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TRP . . . . . 0.525 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -133.27 137.02 45.86 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.719 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -96.46 91.28 5.73 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.477 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 13.3 pt-20 -57.16 -21.99 36.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.806 -1.184 . . . . 0.0 110.197 -178.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -62.16 -15.3 45.14 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 177.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.461 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -130.3 -12.56 4.01 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.755 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.516 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.2 mpp_? 54.42 45.96 26.0 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 -177.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.7 t -114.36 -173.29 2.26 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.443 0.639 . . . . 0.0 110.237 -178.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.425 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -123.95 102.95 8.04 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 177.557 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.517 ' HB3' HD13 ' A' ' 41' ' ' ILE . 25.1 mt -63.15 88.75 0.03 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.367 -1.458 . . . . 0.0 110.617 -176.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.539 ' H ' ' HE3' ' A' ' 74' ' ' LYS . 3.1 pp -120.78 10.1 10.86 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.539 ' HE3' ' H ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -72.22 38.62 0.07 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.134 -0.979 . . . . 0.0 110.846 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.509 ' HB ' ' H ' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -55.65 -6.84 0.22 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.287 -1.508 . . . . 0.0 108.704 179.477 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . 0.498 ' H ' ' C ' ' A' ' 74' ' ' LYS . 16.1 t60 -59.86 -77.05 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 110.035 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -82.34 -118.7 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.098 -1.001 . . . . 0.0 109.647 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.531 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -153.75 150.56 28.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.642 -1.286 . . . . 0.0 109.757 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.66 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -43.86 -47.6 8.25 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.064 -1.022 . . . . 0.0 110.021 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.444 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 7.2 t70 -47.38 -34.17 6.72 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.312 -0.867 . . . . 0.0 109.518 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.1 -30.34 70.33 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -179.44 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 79' ' ' LEU . 1.1 t80 -81.37 -49.62 10.46 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 122.82 9.4 6.29 Favored Glycine 0 N--CA 1.512 3.754 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.541 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 47.0 mt -60.87 161.73 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 O-C-N 122.075 -0.662 . . . . 0.0 109.242 179.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.39 -168.28 1.49 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.91 . . . . 0.0 109.438 179.356 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.64 -26.55 67.12 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.294 -0.879 . . . . 0.0 109.896 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -76.79 -10.09 59.13 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.13 112.32 24.13 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.4 mmtp -97.54 117.29 31.49 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.944 -1.098 . . . . 0.0 109.837 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.487 ' HG ' HD12 ' A' ' 20' ' ' LEU . 5.2 mt -95.64 175.62 6.47 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.41 ' NE2' ' CH2' ' A' ' 64' ' ' TRP . 8.1 mt-30 -134.08 161.56 34.51 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 3.4 t80 -122.94 125.62 45.66 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.498 1.964 0 O-C-N 121.36 -0.837 . . . . 0.0 108.866 -179.219 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 547' ' ' SER . . . . . 0.556 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.4 mp -58.93 135.84 57.7 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.77 -1.206 . . . . 0.0 110.828 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 549' ' ' CYS . . . . . 0.503 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.14 104.13 13.93 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 178.073 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.2 t -51.77 127.06 19.68 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 122.137 0.97 . . . . 0.0 109.599 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.84 -33.24 6.15 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 106.199 -2.76 . . . . 0.0 106.199 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.4 m -107.65 -35.94 6.57 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 553' ' ' GLN . . . . . 0.461 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.6 mm-40 55.58 56.38 6.29 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 122.61 1.195 . . . . 0.0 110.038 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -140.62 124.08 10.24 Favored Pre-proline 0 C--N 1.293 -1.863 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -44.05 136.02 7.84 Favored 'Trans proline' 0 N--CA 1.494 1.526 0 CA-C-N 120.441 1.193 . . . . 0.0 115.113 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 556' ' ' ILE . . . . . 0.556 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.7 mt -95.35 97.97 7.37 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 557' ' ' THR . . . . . 0.423 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.2 p -100.07 91.37 4.75 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.227 -0.92 . . . . 0.0 111.279 -177.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.3 -95.18 0.15 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 107.532 -2.227 . . . . 0.0 107.532 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 559' ' ' ARG . . . . . 0.482 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.0 mmt-85 -114.04 152.71 30.59 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 18.6 p -144.63 126.25 15.09 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.947 -1.096 . . . . 0.0 111.605 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -90.74 146.48 6.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 562' ' ' THR . . . . . 0.759 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.1 m -118.2 147.29 43.53 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 121.834 0.826 . . . . 0.0 109.226 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 563' ' ' ALA . . . . . 0.747 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.94 -129.08 0.25 Allowed 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.563 0.697 . . . . 0.0 109.495 -178.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 564' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.7 mtp -65.66 26.3 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 565' ' ' ALA . . . . . 0.747 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.95 -9.07 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.3 163.14 23.14 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 567' ' ' LYS . . . . . 0.508 ' O ' ' CD1' ' B' ' 568' ' ' PHE . 18.6 mmmt -104.8 174.56 5.83 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 568' ' ' PHE . . . . . 0.508 ' CD1' ' O ' ' B' ' 567' ' ' LYS . 2.9 m-85 -159.81 132.01 6.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.526 -1.359 . . . . 0.0 110.219 -178.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 569' ' ' HIS . . . . . 0.576 ' ND1' ' ND1' ' B' ' 572' ' ' HIS . 9.0 m80 -53.3 113.4 4.68 Favored Pre-proline 0 C--N 1.305 -1.347 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 176.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 570' ' ' PRO . . . . . 0.602 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 31.2 Cg_exo -47.66 -13.26 0.17 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 CA-C-N 120.426 1.188 . . . . 0.0 110.802 -178.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 571' ' ' GLU . . . . . 0.867 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.9 mt-10 -92.22 -52.19 4.81 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 122.079 0.943 . . . . 0.0 110.359 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 572' ' ' HIS . . . . . 0.576 ' ND1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -59.93 -5.67 1.06 Allowed 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.086 -1.009 . . . . 0.0 110.046 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 573' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -127.72 56.01 1.6 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 574' ' ' VAL . . . . . 0.867 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.2 m -94.85 177.27 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.765 0.793 . . . . 0.0 111.448 -178.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 575' ' ' CYS . . . . . 0.599 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.63 143.02 32.22 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 178.599 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.12 73.12 6.33 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 116.065 -2.254 . . . . 0.0 108.703 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 577' ' ' PHE . . . . . 0.416 ' O ' ' N ' ' A' ' 59' ' ' SER . 0.4 OUTLIER -157.52 -36.95 0.07 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 173.883 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 578' ' ' CYS . . . . . 0.584 ' O ' ' N ' ' B' ' 580' ' ' LYS . 29.8 p -137.12 82.43 1.93 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 178.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 579' ' ' LEU . . . . . 0.849 HD13 ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.46 13.96 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -176.493 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 580' ' ' LYS . . . . . 0.584 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -96.05 -38.3 10.26 Favored 'General case' 0 N--CA 1.505 2.323 0 CA-C-N 121.369 1.895 . . . . 0.0 113.024 -178.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 581' ' ' GLN . . . . . 0.602 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.6 tp60 -160.64 140.2 10.85 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 119.47 -2.019 . . . . 0.0 115.652 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 582' ' ' LEU . . . . . 0.599 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.2 tp -135.07 170.1 16.42 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 583' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' B' ' 587' ' ' PHE . 79.2 m-20 -144.8 129.23 17.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.051 -1.031 . . . . 0.0 109.261 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 584' ' ' LYS . . . . . 0.759 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 0.3 OUTLIER -53.85 -16.17 1.66 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.418 -0.801 . . . . 0.0 109.514 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.88 -17.76 53.07 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.8 p -135.63 28.94 3.26 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 587' ' ' PHE . . . . . 0.573 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 1.1 p90 -88.93 106.1 18.19 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 122.762 1.268 . . . . 0.0 109.738 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 588' ' ' LYS . . . . . 0.53 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.05 167.66 10.75 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 589' ' ' GLU . . . . . 0.445 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.7 tt0 -152.07 156.96 40.95 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 122.679 1.228 . . . . 0.0 110.593 -179.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 590' ' ' GLN . . . . . 0.562 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -158.59 146.47 18.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 591' ' ' ASN . . . . . 0.562 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 47.1 22.37 0.22 Allowed 'General case' 0 C--N 1.296 -1.746 0 O-C-N 121.008 -1.057 . . . . 0.0 109.906 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 81.07 -3.96 1.72 Allowed 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.664 -0.648 . . . . 0.0 111.149 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -89.6 123.57 66.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 O-C-N 121.116 -0.99 . . . . 0.0 109.125 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 594' ' ' PRO . . . . . 0.494 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 45.8 Cg_exo -48.26 165.44 0.15 Allowed 'Trans proline' 0 N--CA 1.485 1.026 0 CA-C-N 120.301 1.143 . . . . 0.0 110.923 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 595' ' ' TYR . . . . . 0.53 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.1 m-85 -170.3 141.1 1.97 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.734 -1.229 . . . . 0.0 111.204 -178.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 26.4 m -78.63 154.2 30.44 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 104.627 -2.36 . . . . 0.0 104.627 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 597' ' ' GLN . . . . . 0.606 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.44 -56.5 19.47 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 598' ' ' ASN . . . . . 0.59 ' HA ' HD22 ' B' ' 601' ' ' LEU . 1.4 m120 -44.97 -33.85 2.19 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.63 0.729 . . . . 0.0 109.741 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 68.0 m -78.66 -62.85 1.56 Allowed 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.419 -0.801 . . . . 0.0 110.015 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 600' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -57.78 -47.57 82.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 122.102 -0.374 . . . . 0.0 111.937 -178.17 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 601' ' ' LEU . . . . . 0.98 HD23 ' H ' ' B' ' 602' ' ' LYS . 0.0 OUTLIER -56.28 -51.4 68.31 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 120.721 -1.237 . . . . 0.0 108.438 -177.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 602' ' ' LYS . . . . . 0.98 ' H ' HD23 ' B' ' 601' ' ' LEU . 18.5 tttt -45.56 -24.93 0.38 Allowed 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.389 -0.82 . . . . 0.0 109.972 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 603' ' ' LEU . . . . . 0.452 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.3 OUTLIER -95.91 -57.03 2.47 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.078 -1.014 . . . . 0.0 111.161 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 604' ' ' PHE . . . . . 0.501 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 37.8 m-85 -97.92 22.42 9.29 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.153 -0.967 . . . . 0.0 110.336 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 605' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 58.2 m . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.343 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.4 mmt . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 122.164 0.983 . . . . 0.0 109.692 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.89 -49.81 0.07 Allowed 'General case' 0 C--N 1.298 -1.673 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.273 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.584 ' C ' ' H ' ' A' ' 5' ' ' GLY . 54.6 mt -42.77 -77.68 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 122.025 0.917 . . . . 0.0 109.751 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.592 ' OD2' HD11 ' A' ' 6' ' ' ILE . 7.4 t0 61.29 -7.04 0.1 Allowed 'General case' 0 C--N 1.296 -1.718 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.801 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.584 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 116.73 -12.89 15.16 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.348 -1.901 . . . . 0.0 108.348 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.668 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -114.45 -103.83 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -179.157 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.56 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -156.49 -99.26 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.275 0 O-C-N 120.546 -1.346 . . . . 0.0 109.949 -179.404 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.56 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -144.66 -62.46 0.02 OUTLIER Pre-proline 0 N--CA 1.502 2.135 0 O-C-N 120.981 -1.074 . . . . 0.0 110.717 -179.248 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -43.1 -32.4 2.9 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 CA-C-N 121.238 1.478 . . . . 0.0 109.89 178.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -117.68 -25.02 7.01 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 114.637 -1.165 . . . . 0.0 107.95 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.09 13.82 65.2 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 8' ' ' MET . 12.6 t -164.36 -67.85 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.55 -0.971 . . . . 0.0 109.735 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.667 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 3.5 t80 80.66 -46.84 0.27 Allowed 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 -178.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.667 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 157.47 -35.96 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -166.95 3.45 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 119.841 -0.744 . . . . 0.0 110.228 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.68 30.07 41.05 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.575 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -96.16 125.66 40.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.273 -1.134 . . . . 0.0 109.999 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.502 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -128.97 120.97 27.03 Favored 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 178.18 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.619 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.86 127.74 33.91 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.963 -1.086 . . . . 0.0 109.02 -179.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.477 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.95 134.59 34.65 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 179.332 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -77.98 145.4 36.04 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.487 -0.885 . . . . 0.0 108.981 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.5 t -136.84 104.06 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 CA-C-O 121.829 0.823 . . . . 0.0 109.909 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -79.66 104.5 10.3 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.587 HG13 ' CD2' ' A' ' 92' ' ' PHE . 3.6 t -74.76 118.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.047 -1.461 . . . . 0.0 109.114 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.3 p -85.32 -25.96 26.85 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.411 -0.806 . . . . 0.0 109.39 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -78.04 -8.16 57.84 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.178 -0.951 . . . . 0.0 108.702 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 mt -130.3 -22.64 2.77 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 75.47 12.56 3.16 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.331 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.427 ' O ' ' OD2' ' A' ' 30' ' ' ASP . 74.9 mtp180 -95.32 -178.62 4.5 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.161 -0.962 . . . . 0.0 109.661 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 29' ' ' ARG . 72.4 m-20 -136.16 113.93 11.12 Favored 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 t -113.87 157.54 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-O 121.342 0.592 . . . . 0.0 109.489 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.446 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -128.51 135.99 50.18 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 32' ' ' THR . 3.1 mm? -115.34 113.55 23.95 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.777 -0.577 . . . . 0.0 109.743 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.575 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 9.0 tpt180 -60.25 105.6 0.43 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.9 m -134.18 -169.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.908 0.861 . . . . 0.0 110.591 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.0 p -140.44 172.42 12.75 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.502 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -79.94 46.48 3.15 Favored Glycine 0 N--CA 1.485 1.903 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.442 ' C ' HG21 ' A' ' 78' ' ' THR . 4.9 pt-20 -149.75 4.31 0.57 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.675 -0.897 . . . . 0.0 108.928 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 78' ' ' THR . 3.1 m -87.02 137.29 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 120.945 -1.097 . . . . 0.0 109.959 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.463 ' O ' ' N ' ' A' ' 43' ' ' GLY . 4.2 m80 -79.73 147.83 31.76 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.042 -1.037 . . . . 0.0 108.656 179.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.442 ' C ' ' N ' ' A' ' 43' ' ' GLY . 59.5 mt -48.46 -52.56 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.126 -0.984 . . . . 0.0 109.381 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.64 -15.24 4.28 Favored Glycine 0 N--CA 1.484 1.857 0 N-CA-C 108.107 -1.997 . . . . 0.0 108.107 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -81.43 -28.32 44.4 Favored Glycine 0 N--CA 1.481 1.698 0 N-CA-C 109.077 -1.609 . . . . 0.0 109.077 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.401 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.16 -55.29 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.285 -1.126 . . . . 0.0 109.487 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.9 -37.2 30.35 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.715 -1.24 . . . . 0.0 108.859 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.472 HD13 HD13 ' B' ' 603' ' ' LEU . 5.5 tp -57.52 -65.57 0.61 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.204 -0.935 . . . . 0.0 109.412 179.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -51.42 -59.46 4.21 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.409 -0.807 . . . . 0.0 111.523 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.919 HD23 ' HE2' ' A' ' 61' ' ' HIS . 25.1 tp -45.78 -46.07 15.08 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.091 -1.006 . . . . 0.0 109.83 -178.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.49 ' O ' ' N ' ' A' ' 52' ' ' LEU . 11.6 t -67.21 -48.38 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.032 -1.043 . . . . 0.0 108.826 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -45.04 -40.42 6.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.354 -0.841 . . . . 0.0 109.683 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -66.74 -31.9 72.86 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.349 -0.844 . . . . 0.0 108.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 49' ' ' VAL . 3.7 tp -67.7 -66.55 0.55 Allowed 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.4 t70 64.42 75.89 0.36 Allowed 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 121.747 0.784 . . . . 0.0 110.051 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.545 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.5 p -173.07 152.55 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.865 0 C-N-CA 120.186 -0.605 . . . . 0.0 109.799 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 mttp -71.01 37.52 0.05 Allowed 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' ' 54' ' ' VAL . 19.2 tttp -77.97 179.97 6.44 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.082 -1.011 . . . . 0.0 109.237 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.521 ' N ' ' OD2' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -60.13 92.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.312 -0.867 . . . . 0.0 110.223 -179.134 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.454 ' CE2' HG13 ' A' ' 49' ' ' VAL . 16.4 m0 -91.07 -35.98 14.29 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.253 -0.904 . . . . 0.0 109.511 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.559 ' C ' ' H ' ' A' ' 61' ' ' HIS . 3.7 t -73.99 -34.37 64.18 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.967 -1.083 . . . . 0.0 108.838 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -71.88 19.27 0.07 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.919 ' HE2' HD23 ' A' ' 48' ' ' LEU . 5.7 t-80 -105.65 130.43 53.68 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 122.024 0.916 . . . . 0.0 111.864 -177.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.439 ' O ' ' O ' ' A' ' 93' ' ' THR . . . -170.02 145.19 2.84 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.797 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.1 mm? -94.93 143.03 26.8 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.771 -1.206 . . . . 0.0 110.363 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.522 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.73 150.03 49.97 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.31 93.61 4.6 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.029 -1.044 . . . . 0.0 108.725 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -55.21 -23.73 23.73 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.384 -0.823 . . . . 0.0 111.058 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.528 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.2 mmtp -69.23 -8.89 49.99 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 178.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.6 mmtt -133.32 -12.43 2.77 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.731 -179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.39 46.21 27.09 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 -178.148 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -112.43 -172.93 2.14 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.362 0.601 . . . . 0.0 109.868 -178.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.557 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.04 98.66 5.2 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 177.424 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.402 ' HB3' HD13 ' A' ' 41' ' ' ILE . 29.0 mt -60.34 91.01 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.095 0 CA-C-O 122.618 1.199 . . . . 0.0 109.984 -177.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 71' ' ' TRP . 1.9 pp -123.64 14.55 9.44 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.605 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -90.44 72.36 6.98 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.275 -0.891 . . . . 0.0 109.332 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.529 HG21 ' O ' ' B' ' 602' ' ' LYS . 3.1 m -62.38 -13.67 31.9 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.978 -1.076 . . . . 0.0 110.002 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.69 -50.91 15.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.102 -0.999 . . . . 0.0 109.767 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -75.3 -172.14 1.65 Allowed 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.712 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -137.73 -164.92 1.69 Allowed 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.626 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.572 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.0 mp -69.72 -59.63 2.83 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -46.91 -51.99 15.53 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.137 179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.712 ' CG ' ' H ' ' A' ' 78' ' ' THR . 33.8 mmtt -44.91 -55.01 5.84 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 121.542 0.687 . . . . 0.0 109.966 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.23 -40.22 59.25 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.136 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.88 7.01 8.91 Favored Glycine 0 N--CA 1.5 2.95 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.528 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 52.8 mt -62.0 160.86 2.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.45 -1.029 . . . . 0.0 109.386 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.92 -163.47 0.26 Allowed 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.1 62.55 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.366 -0.834 . . . . 0.0 109.88 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -75.12 -9.93 59.0 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.68 113.64 26.22 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -94.46 116.53 28.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.985 -1.072 . . . . 0.0 109.524 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.443 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.1 mt -94.81 176.79 6.13 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.444 0.64 . . . . 0.0 109.296 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.522 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.8 mt-30 -132.35 159.25 39.74 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 48' ' ' LEU . 0.0 OUTLIER -115.89 94.2 4.58 Favored 'General case' 0 N--CA 1.503 2.183 0 CA-C-O 122.484 1.135 . . . . 0.0 108.023 179.237 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.439 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -146.67 161.07 39.33 Favored Pre-proline 0 N--CA 1.492 1.675 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.493 1.482 0 C-N-CA 122.311 2.007 . . . . 0.0 111.737 179.813 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . 0.421 ' O ' ' O ' ' B' ' 542' ' ' HIS . 7.0 p90 . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . 0.516 ' ND1' ' N ' ' B' ' 542' ' ' HIS . 1.4 m-70 -57.78 -162.35 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.239 -0.913 . . . . 0.0 109.524 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -139.7 -4.53 1.4 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.329 -0.857 . . . . 0.0 109.757 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.512 ' HG2' HH21 ' B' ' 544' ' ' ARG . 0.7 OUTLIER -65.73 103.06 0.82 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.056 -1.027 . . . . 0.0 109.639 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.514 ' NH1' ' O ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -94.09 -153.31 0.37 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.26 -0.9 . . . . 0.0 108.72 179.875 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . 0.514 ' O ' ' NH1' ' B' ' 545' ' ' ARG . . . -170.15 -98.72 0.12 Allowed Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.542 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -167.34 118.74 0.89 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.281 -1.129 . . . . 0.0 108.161 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.25 135.75 57.82 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 120.855 -1.153 . . . . 0.0 110.315 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.479 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.81 103.9 13.46 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.317 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.5 t -51.21 127.05 18.34 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 122.191 0.996 . . . . 0.0 109.59 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.67 -34.59 5.39 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 106.161 -2.776 . . . . 0.0 106.161 -177.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.85 -35.57 7.29 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.457 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.5 mm-40 55.02 56.37 6.67 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.699 1.237 . . . . 0.0 109.957 -178.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -140.64 123.78 10.06 Favored Pre-proline 0 C--N 1.294 -1.835 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -44.21 135.38 8.54 Favored 'Trans proline' 0 N--CA 1.492 1.406 0 CA-C-N 120.489 1.21 . . . . 0.0 114.604 -178.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.1 mt -93.4 98.34 8.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . 0.424 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.3 p -99.38 91.57 5.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.246 -0.909 . . . . 0.0 111.223 -177.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.6 -95.26 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.566 -2.214 . . . . 0.0 107.566 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.481 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -114.76 152.33 32.26 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 177.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.6 126.53 15.4 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.932 -1.105 . . . . 0.0 111.541 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.9 mt -91.01 146.78 5.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 7.9 m -118.48 146.94 44.11 Favored 'General case' 0 C--N 1.292 -1.922 0 CA-C-O 121.79 0.805 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.53 -129.39 0.26 Allowed 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 121.604 0.716 . . . . 0.0 109.331 -178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.554 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.3 mtt -65.78 26.34 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.01 -8.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.73 161.0 23.5 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.73 174.29 5.94 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -160.2 136.34 8.64 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.233 -1.387 . . . . 0.0 109.861 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.572 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.61 114.99 8.3 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.581 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.1 Cg_exo -45.69 -12.44 0.07 OUTLIER 'Trans proline' 0 C--N 1.31 -1.468 0 CA-C-N 120.316 1.148 . . . . 0.0 111.449 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.857 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.9 mt-10 -96.51 -52.73 3.84 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 122.001 0.905 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.439 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 19.1 m170 -57.61 -4.29 0.25 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.897 -1.127 . . . . 0.0 109.886 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.444 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.7 t80 -127.34 55.04 1.62 Allowed 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 178.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.857 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.48 177.73 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.802 0.81 . . . . 0.0 111.116 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.638 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.19 143.42 29.63 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.408 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . 0.453 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -92.98 75.56 4.76 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 116.769 -1.972 . . . . 0.0 109.589 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -153.29 -54.51 0.11 Allowed 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 102.599 -3.112 . . . . 0.0 102.599 173.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.529 ' O ' ' N ' ' B' ' 580' ' ' LYS . 23.8 p -127.57 78.89 1.85 Allowed 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 111.567 -2.561 . . . . 0.0 104.253 177.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.5 mt -53.14 15.55 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.84 -37.13 18.03 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 119.735 -1.853 . . . . 0.0 112.122 -178.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.581 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.8 tp60 -159.65 140.89 12.69 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 119.636 -1.915 . . . . 0.0 114.466 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.638 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.0 tp -136.34 170.68 15.64 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 176.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.434 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.2 m-20 -144.94 128.47 17.03 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.277 -0.89 . . . . 0.0 109.143 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -15.99 0.8 Allowed 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.43 -0.794 . . . . 0.0 109.625 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.17 -21.05 50.98 Favored Glycine 0 N--CA 1.485 1.91 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -133.73 28.91 3.89 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.576 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.7 OUTLIER -89.94 108.98 20.04 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 122.489 1.137 . . . . 0.0 110.115 -179.692 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.5 160.0 14.81 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 179.536 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.8 tt0 -154.82 157.0 37.24 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 122.584 1.183 . . . . 0.0 111.115 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.452 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 2.9 pt20 -156.65 146.04 20.57 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 177.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.668 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.88 23.8 0.74 Allowed 'General case' 0 C--N 1.289 -2.048 0 O-C-N 121.29 -0.881 . . . . 0.0 109.465 -178.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.6 m-20 82.93 -7.06 1.23 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.791 -0.568 . . . . 0.0 111.661 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.7 mttm -86.01 116.22 64.87 Favored Pre-proline 0 C--N 1.293 -1.867 0 O-C-N 121.042 -1.036 . . . . 0.0 110.723 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.471 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.4 Cg_exo -52.57 162.84 2.09 Favored 'Trans proline' 0 N--CA 1.491 1.34 0 CA-C-N 119.919 1.007 . . . . 0.0 112.328 178.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.471 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 20.1 m-85 -171.27 143.63 1.9 Allowed 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.247 -0.908 . . . . 0.0 110.289 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.4 m -75.29 153.87 37.7 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 103.709 -2.7 . . . . 0.0 103.709 173.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.589 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -56.97 -57.13 13.87 Favored 'General case' 0 C--N 1.289 -2.036 0 C-N-CA 117.475 -1.69 . . . . 0.0 106.813 179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.27 -28.77 1.38 Allowed 'General case' 0 C--N 1.301 -1.527 0 O-C-N 121.48 -0.763 . . . . 0.0 109.6 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 80.1 m -82.76 -61.08 1.97 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.312 -0.867 . . . . 0.0 109.039 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.45 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 1.1 t80 -55.45 -55.33 32.98 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.535 -0.728 . . . . 0.0 109.582 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.689 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.21 -42.83 31.16 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.209 -0.932 . . . . 0.0 109.14 -178.939 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.529 ' O ' HG21 ' A' ' 75' ' ' THR . 25.7 tptt -56.34 -23.85 40.01 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.215 -0.928 . . . . 0.0 110.002 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.472 HD13 HD13 ' A' ' 46' ' ' LEU . 4.6 mt -89.16 -56.9 3.09 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.921 -1.112 . . . . 0.0 111.303 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.496 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 16.7 m-85 -109.99 -25.72 10.11 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.262 -0.899 . . . . 0.0 110.59 -178.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.496 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.0 p . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.056 -1.028 . . . . 0.0 109.949 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.6 ttt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.49 -55.72 0.14 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.086 -1.009 . . . . 0.0 108.592 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.428 ' O ' ' N ' ' A' ' 5' ' ' GLY . 74.8 mt -46.0 -84.73 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 122.158 0.98 . . . . 0.0 109.528 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 27.7 t70 45.88 21.86 0.11 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-O 121.846 0.831 . . . . 0.0 109.308 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.428 ' N ' ' O ' ' A' ' 3' ' ' LEU . . . -64.49 -14.49 57.51 Favored Glycine 0 N--CA 1.486 2.03 0 N-CA-C 108.07 -2.012 . . . . 0.0 108.07 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.698 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -108.72 -99.66 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -179.143 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.551 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -153.03 -98.43 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.279 0 O-C-N 120.804 -1.185 . . . . 0.0 109.768 -179.568 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.551 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -144.78 -62.61 0.02 OUTLIER Pre-proline 0 N--CA 1.501 2.08 0 O-C-N 120.98 -1.075 . . . . 0.0 110.572 -179.275 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' O ' ' CD1' ' A' ' 13' ' ' TYR . 63.2 Cg_exo -44.45 -34.64 7.77 Favored 'Trans proline' 0 N--CA 1.493 1.442 0 CA-C-N 121.16 1.45 . . . . 0.0 109.975 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -113.07 -25.7 8.82 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.166 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.76 8.65 78.89 Favored Glycine 0 N--CA 1.487 2.091 0 N-CA-C 109.412 -1.475 . . . . 0.0 109.412 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 8' ' ' MET . 12.8 t -164.17 -35.19 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.217 -1.166 . . . . 0.0 110.541 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.69 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 43.3 m-85 54.15 -96.37 0.06 Allowed 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 -178.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.69 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 160.35 -36.97 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -161.14 4.85 0.07 Allowed 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.458 -0.776 . . . . 0.0 110.048 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.459 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 73.48 36.69 54.25 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 108.51 -1.836 . . . . 0.0 108.51 -179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.499 HG23 ' O ' ' A' ' 17' ' ' THR . 6.7 t -90.18 123.23 33.82 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.57 -0.959 . . . . 0.0 109.907 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.475 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -134.61 123.33 23.63 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.94 130.12 37.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.135 -0.978 . . . . 0.0 109.136 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.46 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.09 134.27 34.61 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 178.74 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -78.14 145.74 35.5 Favored 'General case' 0 C--N 1.297 -1.694 0 O-C-N 121.296 -0.877 . . . . 0.0 109.77 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 36.7 t -136.73 105.37 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.926 0.87 . . . . 0.0 109.767 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -78.72 104.86 9.62 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.549 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -71.95 100.61 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.295 -1.768 0 O-C-N 121.336 -0.852 . . . . 0.0 110.077 -178.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.556 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -76.07 177.0 7.44 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 178.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.9 t70 56.8 6.57 0.31 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.727 -1.233 . . . . 0.0 107.918 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.556 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.8 mt -149.27 -37.66 0.16 Allowed 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.549 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 77.25 15.97 1.72 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.521 178.402 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.7 mtp180 -91.17 -178.97 5.31 Favored 'General case' 0 C--N 1.308 -1.207 0 O-C-N 120.613 -1.304 . . . . 0.0 108.635 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -140.74 116.93 10.6 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.431 HG12 ' N ' ' A' ' 32' ' ' THR . 23.1 t -119.02 157.43 20.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-O 121.56 0.695 . . . . 0.0 109.792 -178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.501 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.43 134.6 43.81 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 179.626 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.501 HD22 ' C ' ' A' ' 32' ' ' THR . 3.8 mm? -114.3 114.13 25.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.6 -0.687 . . . . 0.0 109.398 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.471 ' HE ' ' HB3' ' A' ' 19' ' ' GLU . 1.3 tpp85 -57.84 108.52 0.59 Allowed 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.7 m -137.45 -169.86 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-O 122.062 0.934 . . . . 0.0 110.352 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.3 p -141.81 174.42 10.59 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.475 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -81.48 47.29 3.59 Favored Glycine 0 N--CA 1.487 2.038 0 N-CA-C 109.411 -1.476 . . . . 0.0 109.411 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.419 ' C ' HG21 ' A' ' 78' ' ' THR . 6.0 pt-20 -150.77 4.33 0.49 Allowed 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.737 -0.861 . . . . 0.0 108.994 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.508 ' O ' HG22 ' A' ' 78' ' ' THR . 2.5 m -86.01 143.35 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 O-C-N 120.914 -1.116 . . . . 0.0 109.846 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.503 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -78.56 146.36 34.3 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 179.446 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.465 ' C ' ' N ' ' A' ' 43' ' ' GLY . 97.3 mt -49.57 -56.33 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.734 0 O-C-N 121.053 -1.029 . . . . 0.0 108.828 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.626 ' H ' HG23 ' A' ' 75' ' ' THR . . . -56.45 -9.56 3.47 Favored Glycine 0 N--CA 1.485 1.912 0 N-CA-C 108.089 -2.004 . . . . 0.0 108.089 179.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.503 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.73 -28.0 66.01 Favored Glycine 0 N--CA 1.484 1.878 0 N-CA-C 107.611 -2.196 . . . . 0.0 107.611 178.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.38 -41.41 16.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 41.5 mtm -48.43 -36.67 15.35 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -71.57 -66.03 0.68 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-O 121.391 0.615 . . . . 0.0 110.096 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CB ' HD12 ' A' ' 33' ' ' LEU . 47.0 mttm -53.37 -55.78 22.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.306 -0.871 . . . . 0.0 110.666 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -45.83 -58.45 3.5 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.924 -1.11 . . . . 0.0 109.004 -179.254 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.513 ' O ' ' N ' ' A' ' 52' ' ' LEU . 73.2 t -57.29 -48.26 82.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.752 -0.592 . . . . 0.0 110.25 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -44.7 -40.04 5.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.081 -1.012 . . . . 0.0 109.512 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.508 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -70.7 -26.37 63.38 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.457 -0.777 . . . . 0.0 109.446 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.6 tp -80.04 -75.05 0.27 Allowed 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.338 -0.851 . . . . 0.0 108.801 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 t70 71.4 83.13 0.14 Allowed 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.835 0.826 . . . . 0.0 110.6 178.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.576 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -170.26 151.84 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.0 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.354 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.46 30.71 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 109.379 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.576 ' H ' ' C ' ' A' ' 54' ' ' VAL . 49.7 tttm -77.73 171.58 14.73 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.011 -1.055 . . . . 0.0 108.413 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.497 ' N ' ' OD1' ' A' ' 57' ' ' ASP . 0.6 OUTLIER -92.67 90.7 7.2 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 120.974 -1.079 . . . . 0.0 109.509 -179.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.448 ' O ' ' O ' ' A' ' 61' ' ' HIS . 2.3 m0 -76.59 -51.56 11.4 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.177 -0.952 . . . . 0.0 108.529 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.8 p -41.51 -56.14 2.63 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.312 0.577 . . . . 0.0 110.406 -178.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.425 ' O ' ' O ' ' A' ' 94' ' ' PRO . 10.5 t0 -52.25 -40.5 61.78 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' O ' ' A' ' 58' ' ' TRP . 16.0 m170 -85.0 123.13 30.19 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.81 0.814 . . . . 0.0 110.324 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.16 -179.98 5.66 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.836 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.29 143.03 26.74 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 120.868 -1.145 . . . . 0.0 109.857 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.536 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -130.34 151.7 50.56 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.264 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -110.62 94.55 5.06 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.104 -0.998 . . . . 0.0 108.641 -179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.418 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 8.5 pt-20 -56.12 -23.55 35.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.245 -0.91 . . . . 0.0 110.813 -179.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.536 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.7 mmtp -68.43 -9.64 49.94 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.1 mmtt -133.1 -12.17 2.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.915 -178.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.2 OUTLIER 52.67 46.15 27.27 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -178.151 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -113.61 -173.5 2.28 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 121.612 0.72 . . . . 0.0 110.126 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.482 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.57 102.44 7.37 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 105.243 -2.132 . . . . 0.0 105.243 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.411 ' HB3' HD13 ' A' ' 41' ' ' ILE . 35.6 mt -61.9 86.57 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.325 0 O-C-N 120.504 -1.373 . . . . 0.0 110.548 -176.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.2 pp -120.99 10.88 10.89 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -87.07 36.33 0.73 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.626 HG23 ' H ' ' A' ' 42' ' ' GLY . 21.6 m -46.01 -14.65 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.223 -0.923 . . . . 0.0 110.058 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 8.4 m80 -62.63 -29.03 70.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.136 -0.977 . . . . 0.0 109.249 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 77.1 m95 -104.17 -155.26 0.53 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.438 -0.789 . . . . 0.0 109.406 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.672 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -144.44 171.29 14.56 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.165 0.983 . . . . 0.0 109.386 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.561 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 7.7 mp -48.11 -62.34 1.52 Allowed 'General case' 0 C--N 1.295 -1.78 0 CA-C-O 122.127 0.965 . . . . 0.0 108.515 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -45.94 -52.01 12.33 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-O 121.874 0.845 . . . . 0.0 110.085 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.672 ' CG ' ' H ' ' A' ' 78' ' ' THR . 31.7 mmtt -45.13 -55.58 5.57 Favored 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 121.552 0.691 . . . . 0.0 109.727 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.09 -41.86 63.61 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.419 -0.912 . . . . 0.0 108.979 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 121.65 7.08 8.3 Favored Glycine 0 N--CA 1.499 2.89 0 N-CA-C 108.844 -1.703 . . . . 0.0 108.844 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.532 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 50.5 mt -62.33 161.04 2.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.486 -1.008 . . . . 0.0 109.282 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.532 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.18 -164.63 0.36 Allowed 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.0 -24.29 62.36 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.403 -0.811 . . . . 0.0 109.694 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.426 ' OD1' ' N ' ' A' ' 88' ' ' ALA . 28.1 p30 -76.26 -11.46 59.92 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.267 -0.896 . . . . 0.0 108.67 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.456 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.55 113.52 25.97 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -94.46 117.14 29.67 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.106 -0.996 . . . . 0.0 109.773 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.46 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.5 mt -93.84 176.52 6.32 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.466 0.65 . . . . 0.0 109.25 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.536 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.6 mt-30 -133.34 167.73 19.88 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.441 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 25.0 t80 -124.01 99.0 6.04 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 178.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.55 160.09 39.7 Favored Pre-proline 0 N--CA 1.502 2.154 0 O-C-N 121.356 -0.84 . . . . 0.0 111.037 -176.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . 0.425 ' O ' ' O ' ' A' ' 60' ' ' ASP . 43.1 Cg_exo . . . . . 0 N--CA 1.489 1.207 0 C-N-CA 123.574 2.849 . . . . 0.0 112.796 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 6.8 m80 -54.68 -178.72 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.22 -0.925 . . . . 0.0 109.508 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -159.97 2.03 0.08 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.365 -0.835 . . . . 0.0 110.37 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.458 ' HD3' ' H ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER -77.42 -9.63 58.99 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.028 -1.045 . . . . 0.0 109.798 -179.617 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.434 ' HD2' ' H ' ' B' ' 545' ' ' ARG . 0.1 OUTLIER -97.24 -154.66 0.46 Allowed 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 179.639 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . 163.85 -88.42 0.1 Allowed Glycine 0 N--CA 1.492 2.377 0 C-N-CA 119.733 -1.222 . . . . 0.0 110.203 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m -169.36 120.01 0.7 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.235 -1.156 . . . . 0.0 108.19 -179.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.06 135.17 57.63 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 120.811 -1.181 . . . . 0.0 110.513 -178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.49 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.69 104.15 13.57 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.22 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.1 t -51.46 127.19 19.32 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.24 1.019 . . . . 0.0 109.674 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.7 -34.54 5.41 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 10.8 m -105.75 -35.97 7.2 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.463 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.7 mm-40 55.3 56.4 6.44 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-O 122.682 1.23 . . . . 0.0 109.997 -178.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -140.79 124.08 10.07 Favored Pre-proline 0 C--N 1.294 -1.815 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -44.14 135.15 8.45 Favored 'Trans proline' 0 N--CA 1.491 1.376 0 CA-C-N 120.433 1.19 . . . . 0.0 114.842 -178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.0 mt -93.83 98.41 8.18 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.2 p -98.97 91.34 4.99 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.191 -0.943 . . . . 0.0 111.349 -177.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.0 -96.76 0.16 Allowed Glycine 0 N--CA 1.487 2.07 0 N-CA-C 107.579 -2.209 . . . . 0.0 107.579 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.486 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.2 mmt-85 -111.77 151.95 28.4 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 23.7 p -144.57 126.45 15.35 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.902 -1.124 . . . . 0.0 111.512 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 44.8 mt -90.75 146.06 6.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.466 ' H ' ' HD2' ' B' ' 584' ' ' LYS . 8.8 m -118.8 146.53 44.75 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.847 0.832 . . . . 0.0 109.009 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.739 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -129.29 0.26 Allowed 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.598 0.713 . . . . 0.0 109.287 -178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 3.1 mtt -66.29 26.69 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.739 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.27 -9.06 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.63 159.41 24.03 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . 0.404 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 16.9 mmmt -102.55 174.67 5.79 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 2.5 m-85 -160.29 132.85 6.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.236 -1.386 . . . . 0.0 110.225 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.532 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.6 m80 -53.88 113.81 5.51 Favored Pre-proline 0 C--N 1.304 -1.399 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.597 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.88 -12.53 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.535 0 CA-C-N 120.458 1.199 . . . . 0.0 110.731 -178.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.877 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.5 mt-10 -91.86 -51.81 5.04 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 122.076 0.941 . . . . 0.0 110.243 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.481 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -61.48 -3.22 0.92 Allowed 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.168 -0.957 . . . . 0.0 109.896 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.409 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.1 t80 -132.19 59.21 1.72 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.877 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.9 m -94.59 177.76 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 CA-C-O 121.931 0.872 . . . . 0.0 111.518 -178.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.666 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -84.92 145.52 27.73 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.505 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.64 76.22 3.26 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 116.843 -1.943 . . . . 0.0 109.844 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -152.68 -52.48 0.11 Allowed 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 102.191 -3.263 . . . . 0.0 102.191 173.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.0 p -129.63 80.11 1.94 Allowed 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 111.437 -2.62 . . . . 0.0 104.47 176.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mt -52.43 16.11 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.836 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.52 -36.87 17.37 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 119.632 -1.917 . . . . 0.0 112.551 -178.673 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.597 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.05 140.14 12.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 119.611 -1.93 . . . . 0.0 114.653 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.666 HD13 ' HB2' ' B' ' 575' ' ' CYS . 22.2 tp -137.11 169.54 17.6 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 176.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.1 m-20 -147.09 131.24 17.35 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.313 -0.867 . . . . 0.0 109.229 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.466 ' HD2' ' H ' ' B' ' 562' ' ' THR . 14.6 ptmt -52.58 -21.89 4.37 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.443 -0.785 . . . . 0.0 109.476 179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.64 -17.31 64.13 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -179.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.64 26.95 3.38 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.82 108.51 19.74 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 122.729 1.252 . . . . 0.0 110.06 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.531 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.99 167.88 9.55 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.424 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.5 tt0 -153.15 156.3 38.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.808 -1.183 . . . . 0.0 110.373 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.54 ' CD ' HD21 ' B' ' 591' ' ' ASN . 7.8 tt0 -157.96 146.68 19.21 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 178.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.666 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 50.08 21.99 0.84 Allowed 'General case' 0 C--N 1.29 -1.997 0 O-C-N 121.182 -0.949 . . . . 0.0 109.26 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.1 m-20 81.2 -4.99 1.66 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.786 -0.571 . . . . 0.0 110.716 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . 0.412 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 33.4 mttm -91.36 118.98 68.77 Favored Pre-proline 0 C--N 1.295 -1.795 0 O-C-N 121.258 -0.901 . . . . 0.0 109.575 -179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.0 Cg_exo -49.23 166.44 0.18 Allowed 'Trans proline' 0 N--CA 1.488 1.171 0 CA-C-N 120.135 1.084 . . . . 0.0 111.494 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' B' ' 588' ' ' LYS . 21.9 m-85 -170.55 137.3 1.36 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.08 -1.012 . . . . 0.0 110.756 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 16.3 m -69.55 154.28 42.23 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 173.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.594 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.81 -56.68 19.04 Favored 'General case' 0 C--N 1.289 -2.046 0 C-N-CA 117.479 -1.689 . . . . 0.0 106.459 179.516 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -45.53 -26.53 0.6 Allowed 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.587 -0.696 . . . . 0.0 109.845 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 93.4 m -84.48 -65.4 1.01 Allowed 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.155 -0.965 . . . . 0.0 109.31 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -51.27 -56.66 11.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.497 -0.752 . . . . 0.0 109.38 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.688 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.31 -42.47 31.12 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.262 -0.898 . . . . 0.0 109.064 -179.375 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.405 ' O ' HG21 ' A' ' 75' ' ' THR . 24.1 tptp -58.8 -20.27 48.64 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.366 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 6.4 mt -89.87 -56.44 3.23 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.751 -1.218 . . . . 0.0 110.779 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.41 ' O ' ' C ' ' B' ' 605' ' ' CYS . 9.5 m-85 -107.43 32.35 4.74 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.414 -0.804 . . . . 0.0 109.924 -178.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.41 ' C ' ' O ' ' B' ' 604' ' ' PHE . 9.4 t . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.924 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.643 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.643 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -150.93 -42.31 0.12 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.825 -1.172 . . . . 0.0 108.74 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.896 ' H ' HD12 ' A' ' 3' ' ' LEU . 5.8 mp -55.86 -66.49 0.41 Allowed 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 122.206 1.003 . . . . 0.0 109.242 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.409 ' C ' ' N ' ' A' ' 6' ' ' ILE . 22.9 t70 -73.87 14.37 0.4 Allowed 'General case' 0 C--N 1.296 -1.734 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.051 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.551 ' C ' HD13 ' A' ' 6' ' ' ILE . . . -60.93 -13.74 34.95 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 107.402 -2.279 . . . . 0.0 107.402 179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.772 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -116.13 -95.37 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.571 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -153.03 -98.67 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.181 -0.949 . . . . 0.0 109.758 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.605 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -146.32 -64.49 0.02 OUTLIER Pre-proline 0 N--CA 1.499 1.99 0 O-C-N 121.022 -1.049 . . . . 0.0 110.575 -179.192 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_exo -46.37 -28.54 6.03 Favored 'Trans proline' 0 N--CA 1.494 1.513 0 CA-C-N 121.756 1.663 . . . . 0.0 109.946 178.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -115.79 -26.41 7.4 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -93.6 9.06 74.2 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.605 ' N ' ' O ' ' A' ' 8' ' ' MET . 39.4 t -157.71 -102.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.585 -0.95 . . . . 0.0 109.387 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.568 ' CG ' ' O ' ' A' ' 12' ' ' CYS . 26.3 m-85 -169.25 -104.15 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.358 -0.839 . . . . 0.0 108.872 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -179.06 -41.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -142.6 2.62 1.42 Allowed 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.22 21.71 69.72 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 108.804 -1.718 . . . . 0.0 108.804 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 37.3 p -95.7 122.53 38.56 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.471 -1.017 . . . . 0.0 109.802 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.609 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -131.27 120.93 23.89 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.26 129.37 35.81 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.162 -0.961 . . . . 0.0 109.215 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.474 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.2 OUTLIER -83.79 134.42 34.73 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.183 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.22 146.24 35.05 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.272 -0.893 . . . . 0.0 109.794 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.9 t -138.51 105.44 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 CA-C-O 121.786 0.803 . . . . 0.0 110.059 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.494 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 2.8 m80 -79.59 104.75 10.41 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -71.11 98.21 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.258 -0.901 . . . . 0.0 109.915 -178.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.502 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -70.03 164.28 24.34 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.9 t70 72.09 -43.65 0.57 Allowed 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 25' ' ' THR . 4.8 mt -93.25 -30.77 15.01 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.565 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 73.31 17.45 3.93 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.085 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.7 mtp85 -94.27 -178.73 4.7 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.899 -1.126 . . . . 0.0 109.142 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.494 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 9.9 m-20 -140.18 117.8 11.57 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG12 ' N ' ' A' ' 32' ' ' THR . 20.1 t -120.7 157.76 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.653 0.739 . . . . 0.0 110.013 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.463 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.06 135.36 45.3 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.463 HD22 ' C ' ' A' ' 32' ' ' THR . 3.7 mm? -113.53 111.59 22.15 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.511 -0.743 . . . . 0.0 109.322 -179.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -61.11 102.45 0.21 Allowed 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.9 m -129.95 -169.16 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 CA-C-O 121.936 0.874 . . . . 0.0 109.969 -178.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 16.7 p -139.32 169.59 17.49 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.312 -1.366 . . . . 0.0 107.312 179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.609 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -77.13 44.66 2.17 Favored Glycine 0 N--CA 1.485 1.943 0 C-N-CA 119.386 -1.387 . . . . 0.0 109.634 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.486 ' C ' HG21 ' A' ' 78' ' ' THR . 3.9 pt-20 -146.61 4.04 0.87 Allowed 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.608 -0.936 . . . . 0.0 108.795 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.552 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -88.17 137.19 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.058 -1.026 . . . . 0.0 109.67 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.491 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.8 m80 -76.1 146.78 39.08 Favored 'General case' 0 C--N 1.293 -1.865 0 O-C-N 120.942 -1.099 . . . . 0.0 108.689 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.409 ' C ' ' N ' ' A' ' 43' ' ' GLY . 97.7 mt -45.93 -58.64 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.964 . . . . 0.0 109.583 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.506 ' H ' HG22 ' A' ' 75' ' ' THR . . . -54.8 -16.82 8.08 Favored Glycine 0 C--N 1.297 -1.602 0 N-CA-C 108.496 -1.841 . . . . 0.0 108.496 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -69.34 -29.17 71.94 Favored Glycine 0 N--CA 1.483 1.772 0 N-CA-C 107.941 -2.063 . . . . 0.0 107.941 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 t -84.79 -39.81 14.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.49 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 42.0 mtm -46.68 -37.67 8.68 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.764 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -78.22 -56.94 4.07 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.711 -0.618 . . . . 0.0 110.641 -178.514 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -53.03 -59.85 4.03 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.794 -1.191 . . . . 0.0 110.738 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.68 -44.92 13.84 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.153 -0.967 . . . . 0.0 109.364 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.423 HG13 ' CE2' ' A' ' 58' ' ' TRP . 39.9 t -68.27 -48.01 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.222 -0.924 . . . . 0.0 109.514 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -45.08 -39.24 5.65 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.297 -0.877 . . . . 0.0 109.866 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.54 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 8.7 mtmp? -75.93 -28.38 57.98 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.347 -0.846 . . . . 0.0 110.447 -179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.416 HD23 ' HE1' ' A' ' 58' ' ' TRP . 11.1 tp -60.99 -65.93 0.61 Allowed 'General case' 0 C--N 1.306 -1.305 0 O-C-N 121.084 -1.01 . . . . 0.0 108.878 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.409 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.2 t70 75.53 77.95 0.1 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.909 0.862 . . . . 0.0 110.422 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.557 ' O ' ' N ' ' A' ' 56' ' ' LYS . 3.0 p -175.05 126.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.007 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.477 ' HG3' HD12 ' B' ' 579' ' ' LEU . 18.1 tptt -65.0 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 109.873 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.557 ' N ' ' O ' ' A' ' 54' ' ' VAL . 4.5 ttpm? -77.66 161.23 27.94 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.041 -1.037 . . . . 0.0 108.701 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.418 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -66.71 93.37 0.25 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.296 -0.877 . . . . 0.0 109.38 -179.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.528 ' CZ2' ' O ' ' A' ' 54' ' ' VAL . 16.7 m0 -83.77 -46.49 12.17 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-O 121.839 0.828 . . . . 0.0 109.029 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.8 m -42.69 -55.19 3.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.299 -0.876 . . . . 0.0 110.47 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.42 ' OD1' ' O ' ' A' ' 94' ' ' PRO . 12.5 t0 -50.5 -23.35 2.42 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.407 -0.808 . . . . 0.0 110.215 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.467 ' CB ' ' CZ ' ' A' ' 92' ' ' PHE . 21.9 m-70 -90.89 160.05 15.9 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.998 -1.064 . . . . 0.0 111.864 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.26 170.56 13.07 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.812 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -94.36 146.23 24.2 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.6 -1.313 . . . . 0.0 110.07 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.577 ' NE1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -129.86 151.57 50.29 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.549 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.07 93.77 4.65 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.108 -0.995 . . . . 0.0 108.782 -179.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -55.48 -23.83 27.94 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.29 -0.881 . . . . 0.0 110.771 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.514 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.9 mmtp -67.51 -10.14 48.86 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 106.096 -1.816 . . . . 0.0 106.096 178.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 mmtt -133.48 -12.04 2.74 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.984 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.549 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.5 mpp_? 52.28 46.18 27.12 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 -178.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -114.01 -171.15 1.85 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.607 0.717 . . . . 0.0 110.071 -178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.452 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -126.1 103.64 7.82 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 104.888 -2.264 . . . . 0.0 104.888 177.357 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.02 86.84 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.27 0 O-C-N 120.507 -1.371 . . . . 0.0 111.15 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.37 9.31 10.32 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 177.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.451 ' C ' ' H ' ' A' ' 76' ' ' HIS . 5.6 mmpt? -77.65 54.18 1.18 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.679 -0.638 . . . . 0.0 110.029 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.506 HG22 ' H ' ' A' ' 42' ' ' GLY . 6.1 p -59.13 -5.99 0.79 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.864 -1.147 . . . . 0.0 108.769 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.451 ' H ' ' C ' ' A' ' 74' ' ' LYS . 36.1 m80 -59.41 -40.78 87.76 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.519 -0.738 . . . . 0.0 110.971 -179.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -121.18 -162.46 0.97 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.285 -0.884 . . . . 0.0 109.652 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.608 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -120.24 -164.17 1.07 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.973 -1.079 . . . . 0.0 110.481 -178.257 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.631 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.1 mp -71.63 -59.26 2.85 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -47.01 -52.67 14.26 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 122.018 0.914 . . . . 0.0 109.72 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.608 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.4 mmtt -45.31 -55.06 6.33 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.674 0.75 . . . . 0.0 109.664 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -71.35 -43.62 66.61 Favored 'General case' 0 C--N 1.3 -1.584 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.256 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.37 4.21 8.38 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 108.819 -1.713 . . . . 0.0 108.819 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.52 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 38.4 mt -61.69 161.05 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.423 0 O-C-N 121.582 -0.952 . . . . 0.0 109.35 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -172.13 -161.96 0.19 Allowed 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.361 -0.837 . . . . 0.0 109.143 -179.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.83 -23.98 60.84 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.504 -0.748 . . . . 0.0 109.482 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 p30 -74.5 -11.92 60.35 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.474 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.46 113.15 25.34 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.9 mmtp -94.78 118.12 31.24 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.911 -1.118 . . . . 0.0 109.69 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.473 ' HG ' HD12 ' A' ' 20' ' ' LEU . 11.0 mt -94.41 175.99 6.47 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.561 0.696 . . . . 0.0 109.332 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.577 ' NE2' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -134.87 161.38 35.4 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.467 ' CZ ' ' CB ' ' A' ' 61' ' ' HIS . 61.8 t80 -120.42 91.23 3.49 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -110.06 162.03 22.05 Favored Pre-proline 0 N--CA 1.507 2.386 0 O-C-N 121.848 -0.533 . . . . 0.0 110.291 -177.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . 0.42 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 37.4 Cg_endo . . . . . 0 N--CA 1.497 1.73 0 C-N-CA 122.915 2.41 . . . . 0.0 111.77 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . 0.518 ' CD2' ' O ' ' B' ' 541' ' ' TYR . 73.2 t80 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -60.93 -168.26 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.192 -0.943 . . . . 0.0 109.663 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -98.94 -35.13 10.17 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.541 ' CG ' HH21 ' B' ' 544' ' ' ARG . 0.2 OUTLIER -57.15 127.92 34.36 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.45 -0.781 . . . . 0.0 109.641 -179.906 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.517 ' HG2' HH21 ' B' ' 545' ' ' ARG . 1.0 OUTLIER -73.38 -148.75 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.289 0 O-C-N 121.166 -0.959 . . . . 0.0 109.58 179.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . 176.41 -108.54 0.26 Allowed Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.533 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m -162.29 116.45 1.82 Allowed 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -58.13 134.4 56.43 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 120.942 -1.099 . . . . 0.0 110.713 -178.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.504 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.1 OUTLIER -82.8 104.0 12.71 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 105.866 -1.901 . . . . 0.0 105.866 178.206 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.0 t -48.7 124.75 8.86 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 122.034 0.921 . . . . 0.0 109.318 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 110.23 -37.21 3.86 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 106.53 -2.628 . . . . 0.0 106.53 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.8 m -101.86 -35.99 8.82 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 178.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.456 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 55.35 56.41 6.4 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.815 1.293 . . . . 0.0 109.427 -178.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -140.45 122.44 9.61 Favored Pre-proline 0 N--CA 1.493 1.723 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.23 133.46 9.02 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 CA-C-N 120.539 1.228 . . . . 0.0 114.504 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.533 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -92.04 98.15 8.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.559 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.66 91.14 4.73 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-O 121.992 0.901 . . . . 0.0 111.238 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.07 -96.36 0.15 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 107.283 -2.327 . . . . 0.0 107.283 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.475 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.8 mmt-85 -112.39 149.86 31.92 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.854 -1.536 . . . . 0.0 106.854 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -145.04 126.64 15.11 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.911 -1.118 . . . . 0.0 111.521 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 43.0 mt -91.4 146.41 6.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.574 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.6 m -120.13 146.39 46.01 Favored 'General case' 0 C--N 1.292 -1.899 0 CA-C-O 121.873 0.844 . . . . 0.0 108.945 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.716 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.74 -129.22 0.26 Allowed 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.551 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.88 25.94 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.748 0 O-C-N 121.618 -0.677 . . . . 0.0 109.245 179.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.716 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.99 -8.13 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -178.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 150.63 28.11 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . 0.414 ' O ' ' CD2' ' B' ' 568' ' ' PHE . 18.2 mmmt -96.49 174.72 6.71 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . 0.414 ' CD2' ' O ' ' B' ' 567' ' ' LYS . 0.9 OUTLIER -162.27 132.07 4.58 Favored 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 117.568 -1.653 . . . . 0.0 111.31 -178.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.592 ' O ' ' N ' ' B' ' 571' ' ' GLU . 2.6 m80 -50.59 112.27 2.76 Favored Pre-proline 0 C--N 1.297 -1.687 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 176.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.461 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 51.1 Cg_exo -44.62 -4.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.311 -1.415 0 CA-C-N 120.186 1.102 . . . . 0.0 114.395 -178.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.967 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.8 mt-10 -112.16 -53.66 2.69 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-O 122.749 1.261 . . . . 0.0 108.814 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -46.78 -15.15 0.03 OUTLIER 'General case' 0 C--N 1.285 -2.205 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.453 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.519 ' N ' ' O ' ' B' ' 571' ' ' GLU . 55.1 t80 -118.53 54.08 0.96 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 -179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.967 HG13 ' O ' ' B' ' 571' ' ' GLU . 14.1 m -91.83 176.13 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.593 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -71.39 141.2 50.35 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.627 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . 0.49 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.87 74.88 6.48 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 116.377 -2.129 . . . . 0.0 108.486 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -150.85 -60.58 0.18 Allowed 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 100.839 -3.763 . . . . 0.0 100.839 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.425 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.6 OUTLIER -104.8 155.28 19.04 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 176.156 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 1.066 ' H ' HD22 ' B' ' 579' ' ' LEU . 0.0 OUTLIER -105.55 14.21 28.88 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.033 -1.042 . . . . 0.0 111.265 -178.091 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.573 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -102.86 -38.99 7.16 Favored 'General case' 0 N--CA 1.512 2.658 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -176.011 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.461 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.1 tp60 -162.42 142.0 9.46 Favored 'General case' 0 N--CA 1.504 2.261 0 CA-C-N 122.447 2.385 . . . . 0.0 115.979 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.593 HD13 ' HB2' ' B' ' 575' ' ' CYS . 22.7 tp -137.41 168.4 19.72 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 107.027 -1.472 . . . . 0.0 107.027 174.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.516 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.8 m-20 -150.54 133.85 16.3 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.859 -1.15 . . . . 0.0 109.843 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -50.39 -18.85 0.7 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.563 0.697 . . . . 0.0 109.697 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.76 -21.26 51.33 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 108.955 -1.658 . . . . 0.0 108.955 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . 0.449 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.5 p -134.62 26.79 3.71 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.58 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.65 108.37 19.77 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 122.589 1.185 . . . . 0.0 110.256 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.49 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.73 169.85 8.37 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 179.063 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.422 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.7 tt0 -151.34 157.19 42.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.653 -1.279 . . . . 0.0 110.832 -178.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.621 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.7 OUTLIER -153.22 146.07 24.42 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.527 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.03 23.54 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.057 -1.027 . . . . 0.0 110.064 -179.728 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.487 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.2 m-20 82.66 -4.82 1.35 Allowed 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.811 -0.556 . . . . 0.0 110.702 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 39.1 mttm -91.57 124.54 60.54 Favored Pre-proline 0 C--N 1.295 -1.787 0 O-C-N 121.302 -0.874 . . . . 0.0 109.698 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.492 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.8 Cg_exo -49.09 163.64 0.32 Allowed 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 119.971 1.025 . . . . 0.0 112.479 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.499 ' OH ' HD21 ' A' ' 46' ' ' LEU . 13.5 m-85 -170.73 141.69 1.86 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.335 -0.853 . . . . 0.0 109.796 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . 0.464 ' SG ' ' CB ' ' B' ' 575' ' ' CYS . 6.0 m -74.49 157.05 36.23 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.57 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.83 -57.31 13.21 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 179.1 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.56 -30.18 2.14 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.454 -0.778 . . . . 0.0 108.936 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 8.6 m -79.43 -62.56 1.65 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.545 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.3 OUTLIER -56.73 -55.96 27.51 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-O 121.15 0.5 . . . . 0.0 110.585 -179.685 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.637 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -47.66 -42.16 23.96 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.228 -0.92 . . . . 0.0 109.091 -178.566 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.472 ' O ' HG21 ' A' ' 75' ' ' THR . 28.3 tttt -59.67 -20.9 59.27 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.084 -1.01 . . . . 0.0 110.187 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.764 HD13 HD12 ' A' ' 46' ' ' LEU . 6.6 mt -90.6 -56.74 3.08 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.131 -0.98 . . . . 0.0 111.509 -178.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.621 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.2 m-85 -89.37 30.64 0.97 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.874 -1.141 . . . . 0.0 110.396 -178.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.503 ' SG ' ' O ' ' B' ' 601' ' ' LEU . 3.2 m . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.912 -1.117 . . . . 0.0 109.291 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 ttt . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.74 -56.05 0.2 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.014 -1.054 . . . . 0.0 108.619 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 74.6 mt -44.92 -85.15 0.0 OUTLIER 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 122.055 0.931 . . . . 0.0 109.487 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.4 t0 46.38 24.19 0.27 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 121.845 0.831 . . . . 0.0 109.337 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.09 -14.14 58.67 Favored Glycine 0 N--CA 1.487 2.037 0 N-CA-C 108.129 -1.989 . . . . 0.0 108.129 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.685 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -110.53 -98.86 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.667 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.136 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.549 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -152.2 -98.42 0.05 Allowed 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.94 -1.1 . . . . 0.0 109.595 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.549 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -145.45 -62.69 0.02 OUTLIER Pre-proline 0 N--CA 1.499 2.017 0 O-C-N 120.974 -1.079 . . . . 0.0 110.74 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -43.44 -32.56 3.63 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 CA-C-N 121.166 1.452 . . . . 0.0 110.091 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -117.04 -24.07 7.72 Favored 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.064 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.34 4.11 84.13 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.945 -1.262 . . . . 0.0 109.945 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.52 ' N ' ' O ' ' A' ' 8' ' ' MET . 17.5 t -167.68 -25.94 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.026 -1.279 . . . . 0.0 111.043 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 54.22 -127.92 2.31 Favored 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 -178.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -171.35 -39.0 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.02 -1.05 . . . . 0.0 109.782 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -157.59 9.03 0.17 Allowed 'General case' 0 C--N 1.3 -1.577 0 O-C-N 121.209 -0.932 . . . . 0.0 110.044 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 80.97 42.29 9.73 Favored Glycine 0 N--CA 1.486 2.028 0 N-CA-C 108.168 -1.973 . . . . 0.0 108.168 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.675 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 12.4 p -79.45 129.62 34.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.481 -1.011 . . . . 0.0 109.648 -179.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.548 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -153.04 137.67 16.88 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.589 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -90.38 132.3 35.68 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.014 -1.053 . . . . 0.0 110.1 -179.575 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.524 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.42 134.2 34.48 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.27 145.73 35.25 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.169 -0.957 . . . . 0.0 108.69 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.2 t -138.51 106.7 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-O 121.78 0.8 . . . . 0.0 110.193 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.521 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 16.4 m170 -82.11 103.97 12.11 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 178.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.543 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.0 t -73.97 108.61 5.6 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 118.654 -1.219 . . . . 0.0 108.22 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.89 -23.46 38.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.225 -0.922 . . . . 0.0 109.057 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -78.84 -8.33 58.71 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.1 mt -130.15 -21.06 2.99 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.543 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.98 12.55 2.26 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 122.033 -0.417 . . . . 0.0 110.143 -179.579 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 16.5 mtp-105 -98.3 -178.12 3.93 Favored 'General case' 0 N--CA 1.482 1.164 0 O-C-N 121.03 -1.044 . . . . 0.0 109.856 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.521 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 20.3 m-20 -135.97 116.68 13.98 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 32' ' ' THR . 29.6 t -115.93 158.04 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-O 121.626 0.727 . . . . 0.0 109.772 -179.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.453 ' N ' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -132.72 131.05 40.81 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.912 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.43 HD22 ' O ' ' A' ' 32' ' ' THR . 2.7 mm? -115.45 118.11 32.26 Favored 'General case' 0 C--N 1.301 -1.513 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.675 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -60.41 139.59 57.61 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 178.459 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.599 ' HB ' HG11 ' A' ' 39' ' ' VAL . 5.5 m -160.26 -175.16 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.443 0 CA-C-O 121.882 0.849 . . . . 0.0 109.741 -177.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.519 ' O ' HG12 ' A' ' 39' ' ' VAL . 15.1 p -140.49 173.05 11.88 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 178.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.97 49.74 4.02 Favored Glycine 0 C--N 1.29 -2.009 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -153.5 1.69 0.26 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.76 -0.847 . . . . 0.0 109.356 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.599 HG11 ' HB ' ' A' ' 35' ' ' VAL . 0.2 OUTLIER -85.8 151.41 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.717 -1.239 . . . . 0.0 108.303 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.64 ' CD2' ' H ' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -87.67 142.75 27.59 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 121.235 -0.916 . . . . 0.0 109.17 179.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.65 HD13 ' HB3' ' A' ' 72' ' ' LEU . 38.6 mt -47.16 -57.81 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-O 122.179 0.99 . . . . 0.0 109.222 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.413 ' H ' HG23 ' A' ' 75' ' ' THR . . . -53.69 -14.36 3.71 Favored Glycine 0 C--N 1.295 -1.733 0 N-CA-C 108.512 -1.835 . . . . 0.0 108.512 -179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.79 -25.48 62.48 Favored Glycine 0 N--CA 1.483 1.818 0 N-CA-C 109.232 -1.547 . . . . 0.0 109.232 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -79.58 -55.09 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.413 -1.051 . . . . 0.0 109.757 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -21.95 4.03 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.449 -1.407 . . . . 0.0 108.585 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.504 ' C ' HD23 ' A' ' 46' ' ' LEU . 3.2 tt -71.69 -58.32 3.59 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 178.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -61.76 -51.87 66.56 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.306 -0.871 . . . . 0.0 110.625 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.432 HD21 ' CD1' ' A' ' 92' ' ' PHE . 57.3 tp -44.82 -54.24 6.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.089 -1.007 . . . . 0.0 110.604 -178.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.4 t -65.88 -44.06 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.787 0 O-C-N 120.722 -1.236 . . . . 0.0 110.098 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -45.01 -38.45 4.81 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.125 -0.985 . . . . 0.0 109.986 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.532 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.3 mtmp? -67.91 -48.5 65.81 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.381 -0.824 . . . . 0.0 110.421 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.497 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.8 OUTLIER -65.0 -68.11 0.39 Allowed 'General case' 0 C--N 1.307 -1.262 0 O-C-N 120.877 -1.139 . . . . 0.0 108.33 179.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.497 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 10.2 t0 80.36 88.23 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 122.119 0.962 . . . . 0.0 110.377 178.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.488 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.1 p -169.78 140.12 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.285 -2.223 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.276 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.8 mttp -67.32 35.54 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.639 -0.663 . . . . 0.0 110.567 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.488 ' H ' ' C ' ' A' ' 54' ' ' VAL . 13.6 ttmm -78.81 144.9 34.64 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 118.385 -1.326 . . . . 0.0 108.85 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.526 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 4.4 m-20 -54.73 96.11 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.628 -0.67 . . . . 0.0 110.073 -179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.47 ' O ' ' N ' ' A' ' 61' ' ' HIS . 47.6 m95 -107.21 -29.64 9.22 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.329 -0.857 . . . . 0.0 109.612 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.9 p -44.33 -42.89 7.11 Favored 'General case' 0 C--N 1.298 -1.653 0 O-C-N 121.617 -0.677 . . . . 0.0 110.149 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.427 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 15.7 t0 -75.1 -15.87 60.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.385 -0.822 . . . . 0.0 109.621 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.526 ' CE1' ' O ' ' A' ' 57' ' ' ASP . 2.4 m80 -85.18 128.36 34.64 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.209 -0.932 . . . . 0.0 110.789 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -139.3 176.82 8.38 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.775 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.7 mm? -94.75 145.12 25.09 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.818 -1.176 . . . . 0.0 110.304 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.516 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.21 151.53 49.15 Favored 'General case' 0 N--CA 1.501 2.081 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.539 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -111.84 94.7 5.08 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.078 -1.014 . . . . 0.0 108.97 -179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.415 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 10.4 pt-20 -56.04 -23.69 34.84 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.23 -0.919 . . . . 0.0 110.762 -179.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.523 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.9 mmtp -68.39 -9.57 49.21 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 178.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.27 -12.14 2.8 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.983 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.539 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.65 46.65 26.32 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 107.218 -1.401 . . . . 0.0 107.218 -178.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.8 t -115.06 -170.73 1.81 Allowed 'General case' 0 N--CA 1.492 1.655 0 CA-C-O 121.313 0.578 . . . . 0.0 109.774 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.532 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.55 97.42 4.54 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.525 -1.657 . . . . 0.0 106.525 177.212 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 41' ' ' ILE . 11.1 mt -60.85 85.32 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.901 -1.124 . . . . 0.0 110.05 -176.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.511 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -119.97 10.27 11.46 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.461 ' HD3' HD12 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -91.54 68.52 5.7 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.427 -0.796 . . . . 0.0 109.398 179.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.417 ' O ' ' O ' ' B' ' 605' ' ' CYS . 3.7 m -60.24 -5.51 1.13 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 120.995 -1.065 . . . . 0.0 108.968 179.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.44 ' H ' ' C ' ' A' ' 74' ' ' LYS . 40.1 m80 -59.27 -61.75 2.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.363 -0.836 . . . . 0.0 112.099 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.461 ' CH2' HD11 ' A' ' 41' ' ' ILE . 11.7 p-90 -88.07 -159.01 0.5 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.689 -1.257 . . . . 0.0 110.852 -178.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.664 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -139.23 165.27 27.62 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.92 -1.113 . . . . 0.0 110.24 -178.208 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.471 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 11.1 mp -38.95 -65.4 0.37 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.076 0.941 . . . . 0.0 109.721 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -44.49 -52.29 8.04 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-O 121.852 0.834 . . . . 0.0 110.259 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.664 ' CG ' ' H ' ' A' ' 78' ' ' THR . 40.9 mmtt -45.25 -54.65 6.76 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-O 121.46 0.648 . . . . 0.0 109.722 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -73.86 -43.85 57.34 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 119.098 -1.041 . . . . 0.0 108.908 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 119.13 11.64 7.4 Favored Glycine 0 N--CA 1.5 2.913 0 N-CA-C 108.878 -1.689 . . . . 0.0 108.878 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.55 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 33.7 mt -61.21 161.19 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 121.574 -0.957 . . . . 0.0 108.866 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -161.99 -169.15 2.11 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.297 -0.877 . . . . 0.0 109.239 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.537 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -69.91 -19.97 63.38 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 121.614 -0.679 . . . . 0.0 109.562 179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.3 p30 -80.47 -8.26 59.48 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.289 -0.882 . . . . 0.0 109.184 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.524 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -93.07 113.35 25.59 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -93.28 115.88 28.46 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 120.767 -1.208 . . . . 0.0 109.551 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.406 ' HG ' HD12 ' A' ' 20' ' ' LEU . 9.9 mt -97.55 176.99 5.65 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 121.698 0.761 . . . . 0.0 109.507 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.516 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.2 mt-30 -132.81 168.59 18.11 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.194 -1.409 . . . . 0.0 107.194 179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.432 ' CD1' HD21 ' A' ' 48' ' ' LEU . 20.2 t80 -133.31 99.35 4.5 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 178.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.5 162.32 42.63 Favored Pre-proline 0 N--CA 1.504 2.23 0 C-N-CA 120.214 -0.595 . . . . 0.0 111.642 -176.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_endo . . . . . 0 N--CA 1.499 1.85 0 C-N-CA 123.094 2.53 . . . . 0.0 111.763 178.529 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.306 0.574 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . 0.458 ' ND1' ' N ' ' B' ' 542' ' ' HIS . 2.9 m80 -61.59 -168.11 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.282 -0.886 . . . . 0.0 109.635 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -141.92 -0.02 1.36 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.333 -0.854 . . . . 0.0 109.695 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.7 103.67 14.71 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.072 -1.017 . . . . 0.0 109.561 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.427 ' H ' ' HD3' ' B' ' 545' ' ' ARG . 0.1 OUTLIER -80.9 -161.67 0.41 Allowed 'General case' 0 C--N 1.307 -1.28 0 O-C-N 121.144 -0.973 . . . . 0.0 108.985 179.628 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -166.69 -101.49 0.15 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m -168.41 119.09 0.78 Allowed 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -59.03 135.04 57.5 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.783 -1.198 . . . . 0.0 110.211 -178.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.52 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.62 103.73 13.17 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 178.512 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.6 t -48.82 125.1 9.6 Favored 'General case' 0 C--N 1.298 -1.673 0 CA-C-O 122.035 0.921 . . . . 0.0 109.639 -178.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.5 -34.62 5.38 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 106.479 -2.648 . . . . 0.0 106.479 -177.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.3 m -105.31 -35.26 7.6 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.452 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.3 mm-40 54.55 56.42 6.84 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 122.824 1.297 . . . . 0.0 109.881 -178.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 59.4 mmtt -140.71 123.62 9.92 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -44.24 134.09 8.94 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 CA-C-N 120.574 1.241 . . . . 0.0 114.433 -178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.3 mt -91.74 98.31 8.23 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . 0.429 ' O ' ' OG1' ' B' ' 557' ' ' THR . 5.5 p -99.46 91.01 4.72 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.286 -0.884 . . . . 0.0 111.159 -177.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.74 -96.2 0.15 Allowed Glycine 0 N--CA 1.488 2.123 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.462 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 2.6 mmt-85 -113.88 150.58 33.44 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 177.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 26.5 p -144.46 126.66 15.67 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.951 -1.093 . . . . 0.0 111.76 -179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 40.9 mt -91.32 146.68 5.94 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.622 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.438 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 12.2 m -120.72 146.53 46.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 121.81 0.814 . . . . 0.0 108.897 179.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.724 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.7 -129.02 0.26 Allowed 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.5 mtp -65.79 25.89 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.559 -0.713 . . . . 0.0 109.147 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.724 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.11 -8.51 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 -178.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.25 148.7 28.24 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.295 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -95.94 174.65 6.83 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -161.49 137.57 8.04 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.142 -1.423 . . . . 0.0 110.121 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.612 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.0 m80 -57.9 117.05 16.65 Favored Pre-proline 0 C--N 1.3 -1.578 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.514 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.4 Cg_exo -44.11 -8.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.302 0 CA-C-N 120.114 1.076 . . . . 0.0 112.758 -178.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.717 ' O ' HG13 ' B' ' 574' ' ' VAL . 8.2 mt-10 -106.41 -53.16 2.67 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-O 122.149 0.976 . . . . 0.0 109.623 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -55.5 -5.0 0.11 Allowed 'General case' 0 C--N 1.292 -1.927 0 O-C-N 120.312 -1.493 . . . . 0.0 109.495 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.492 ' H ' ' C ' ' B' ' 571' ' ' GLU . 39.8 t80 -125.44 52.96 1.58 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.717 HG13 ' O ' ' B' ' 571' ' ' GLU . 11.6 m -92.93 177.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.639 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -80.39 141.85 34.95 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.53 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.4 75.6 3.89 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 116.842 -1.943 . . . . 0.0 109.915 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . 0.407 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 69.1 t80 -153.33 -54.12 0.11 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 102.459 -3.163 . . . . 0.0 102.459 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.521 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.7 p -126.75 77.75 1.74 Allowed 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 111.68 -2.509 . . . . 0.0 104.396 176.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 0.703 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.3 mp -53.04 16.85 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.521 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.1 -37.71 21.67 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 119.545 -1.972 . . . . 0.0 112.233 -178.718 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -161.54 143.89 11.92 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 119.54 -1.975 . . . . 0.0 113.843 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.639 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.5 tp -136.62 170.59 15.82 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.468 ' O ' ' N ' ' B' ' 587' ' ' PHE . 70.3 m-20 -149.61 131.79 15.44 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.182 -0.949 . . . . 0.0 109.455 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.438 ' HE3' ' H ' ' B' ' 562' ' ' THR . 14.7 ptpt -51.11 -19.16 1.03 Allowed 'General case' 0 C--N 1.302 -1.494 0 CA-C-O 121.564 0.697 . . . . 0.0 109.813 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.0 -20.54 55.28 Favored Glycine 0 N--CA 1.485 1.942 0 N-CA-C 108.889 -1.685 . . . . 0.0 108.889 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -134.34 26.62 3.8 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.553 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.52 107.73 19.35 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-O 122.657 1.218 . . . . 0.0 110.389 -179.892 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.97 166.25 10.56 Favored 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.428 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.1 tt0 -153.01 157.28 40.3 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.815 -1.178 . . . . 0.0 110.653 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.503 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.6 tp-100 -156.22 146.13 21.2 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.649 -1.612 . . . . 0.0 106.649 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.573 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 46.41 23.65 0.24 Allowed 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.041 -1.037 . . . . 0.0 109.643 -179.59 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.477 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 81.55 -5.74 1.55 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.782 -0.574 . . . . 0.0 110.8 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -88.34 116.25 65.67 Favored Pre-proline 0 C--N 1.294 -1.806 0 O-C-N 121.206 -0.934 . . . . 0.0 109.54 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.515 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 42.6 Cg_exo -49.51 164.2 0.36 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 CA-C-N 119.908 1.003 . . . . 0.0 112.141 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.515 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.77 140.03 1.6 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.179 -0.951 . . . . 0.0 110.163 -179.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 11.0 m -73.51 152.88 40.53 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 174.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.546 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -55.69 -57.46 11.9 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 179.52 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -45.35 -29.44 1.05 Allowed 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.58 -0.7 . . . . 0.0 109.316 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 76.2 m -84.62 -66.17 0.92 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.611 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -43.86 -56.5 3.84 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 121.656 0.741 . . . . 0.0 109.577 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.643 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.73 -43.31 62.83 Favored 'General case' 0 C--N 1.293 -1.854 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -178.802 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.4 tmtt? -64.69 -20.48 66.34 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.705 -1.247 . . . . 0.0 110.807 -179.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -90.17 -56.46 3.21 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 120.3 -1.5 . . . . 0.0 112.067 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.29 30.73 4.37 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.223 -0.923 . . . . 0.0 112.381 -176.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.417 ' O ' ' O ' ' A' ' 75' ' ' THR . 2.4 t . . . . . 0 N--CA 1.5 2.058 0 O-C-N 120.604 -1.31 . . . . 0.0 108.805 178.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.297 0.57 . . . . 0.0 109.595 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.89 -47.47 0.13 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.27 -0.894 . . . . 0.0 108.756 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.542 ' C ' ' H ' ' A' ' 5' ' ' GLY . 57.0 mt -45.68 -76.37 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.994 0.902 . . . . 0.0 109.369 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.515 ' OD2' HD11 ' A' ' 6' ' ' ILE . 9.7 t0 61.38 -7.09 0.1 Allowed 'General case' 0 C--N 1.295 -1.791 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.942 -179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.542 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 116.75 -11.89 15.44 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 108.478 -1.849 . . . . 0.0 108.478 179.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.622 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -116.2 -109.46 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -179.023 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.503 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -159.47 -95.09 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.255 0 O-C-N 120.313 -1.492 . . . . 0.0 110.394 -179.297 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.503 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -130.46 -53.85 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.556 0 O-C-N 120.951 -1.093 . . . . 0.0 111.661 -179.16 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -56.11 -28.73 71.56 Favored 'Trans proline' 0 N--CA 1.497 1.703 0 CA-C-N 121.074 1.419 . . . . 0.0 110.345 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -119.61 -27.5 5.49 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -83.33 1.5 88.62 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 13.1 t -157.92 -35.57 0.07 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.281 -1.129 . . . . 0.0 109.416 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.612 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 1.7 t80 77.97 -33.16 0.17 Allowed 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.612 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 169.92 -42.2 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.473 ' N ' ' SG ' ' A' ' 12' ' ' CYS . 29.8 t70 -159.21 9.13 0.12 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.216 -0.928 . . . . 0.0 110.281 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.531 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 100.41 38.48 3.49 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 108.443 -1.863 . . . . 0.0 108.443 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.92 122.4 23.37 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.568 -0.96 . . . . 0.0 109.532 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.531 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -133.01 124.55 27.9 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.616 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.12 128.71 34.21 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.819 -1.176 . . . . 0.0 109.134 -179.798 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.516 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.01 133.35 34.68 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.573 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.55 145.5 34.8 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.396 -0.815 . . . . 0.0 110.019 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.8 t -135.2 100.42 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.762 0.792 . . . . 0.0 109.066 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.534 ' CE1' ' OD1' ' A' ' 30' ' ' ASP . 7.7 m-70 -77.94 104.06 8.26 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.549 HG13 ' CD1' ' A' ' 92' ' ' PHE . 4.8 t -74.75 117.88 19.62 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 C-N-CA 118.128 -1.429 . . . . 0.0 108.965 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.423 ' H ' HG23 ' A' ' 25' ' ' THR . 0.6 OUTLIER -85.27 -23.6 28.11 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.371 -0.831 . . . . 0.0 109.72 -179.333 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.481 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -79.92 -8.86 59.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.044 -1.035 . . . . 0.0 108.373 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.404 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.0 mt -129.0 -23.62 3.02 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.523 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.22 12.11 2.78 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 -179.42 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -94.92 -177.96 4.34 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.197 -0.939 . . . . 0.0 109.445 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.534 ' OD1' ' CE1' ' A' ' 23' ' ' HIS . 2.1 m-20 -136.7 113.19 10.06 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.401 HG12 ' N ' ' A' ' 32' ' ' THR . 21.4 t -107.76 157.48 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.494 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.2 139.79 47.19 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 2.3 mm? -120.16 112.55 19.23 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.663 -0.648 . . . . 0.0 109.56 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.496 ' NH1' ' CG ' ' A' ' 13' ' ' TYR . 15.7 tpt180 -61.47 107.01 0.72 Allowed 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -135.33 -168.94 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 CA-C-O 121.842 0.83 . . . . 0.0 110.339 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.6 p -141.84 173.35 11.59 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.17 44.52 2.65 Favored Glycine 0 N--CA 1.484 1.88 0 N-CA-C 109.191 -1.563 . . . . 0.0 109.191 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.431 ' C ' HG21 ' A' ' 78' ' ' THR . 0.2 OUTLIER -144.67 2.95 1.09 Allowed 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.615 -0.932 . . . . 0.0 108.843 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.575 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -89.08 135.21 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 O-C-N 121.146 -0.971 . . . . 0.0 110.259 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.488 ' O ' ' N ' ' A' ' 43' ' ' GLY . 9.4 m-70 -78.4 148.2 33.75 Favored 'General case' 0 C--N 1.295 -1.768 0 O-C-N 120.921 -1.112 . . . . 0.0 108.866 179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.529 HD12 ' O ' ' A' ' 74' ' ' LYS . 38.7 mt -47.36 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.131 -0.981 . . . . 0.0 109.251 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.56 -13.36 2.87 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 108.625 -1.79 . . . . 0.0 108.625 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -82.23 -26.94 46.28 Favored Glycine 0 N--CA 1.483 1.833 0 N-CA-C 109.261 -1.536 . . . . 0.0 109.261 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.7 t -80.79 -55.26 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.321 -1.105 . . . . 0.0 109.543 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.463 ' SD ' HD22 ' B' ' 603' ' ' LEU . 0.0 OUTLIER -49.56 -40.58 38.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 120.766 -1.209 . . . . 0.0 108.996 179.771 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.8 tt -54.47 -58.88 5.73 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.079 -1.013 . . . . 0.0 109.35 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -59.39 -57.84 11.22 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.246 -0.909 . . . . 0.0 110.919 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.5 tp -44.81 -41.73 7.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.366 -0.834 . . . . 0.0 110.182 -178.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.634 HG22 ' CD2' ' A' ' 58' ' ' TRP . 93.2 t -74.67 -43.49 47.54 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.821 -1.174 . . . . 0.0 109.52 179.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -45.79 -38.87 7.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.257 -0.902 . . . . 0.0 108.933 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.533 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 54.5 mttp -67.44 -57.38 6.66 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.479 -0.763 . . . . 0.0 109.294 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.536 ' C ' ' H ' ' A' ' 54' ' ' VAL . 3.8 mm? -67.78 -66.22 0.59 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.523 ' N ' ' O ' ' A' ' 49' ' ' VAL . 2.8 t70 78.0 -34.02 0.18 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.875 0.845 . . . . 0.0 109.627 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.536 ' H ' ' C ' ' A' ' 52' ' ' LEU . 10.4 p -20.15 134.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.286 -2.169 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.481 178.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.453 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.3 tttt -69.9 36.42 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.133 -0.98 . . . . 0.0 110.457 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.494 ' NZ ' ' CB ' ' A' ' 56' ' ' LYS . 3.2 ttpm? -83.97 169.21 15.25 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.23 -0.919 . . . . 0.0 108.531 179.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.535 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -79.71 123.54 27.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.021 -1.049 . . . . 0.0 109.545 -179.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.651 ' CZ3' ' CZ ' ' A' ' 92' ' ' PHE . 93.3 m95 -119.09 -48.54 2.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.453 -0.779 . . . . 0.0 109.934 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 p -45.51 -55.97 5.61 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.15 -0.968 . . . . 0.0 109.913 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -55.17 -32.17 61.95 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.535 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 8.8 m-70 -83.55 168.74 16.13 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.981 0.896 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.58 178.57 4.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.817 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -94.24 148.59 22.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.87 -1.144 . . . . 0.0 108.863 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.514 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.35 151.32 48.92 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -178.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.546 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.54 94.01 4.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.626 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.41 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 17.9 pt-20 -55.12 -24.2 24.86 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.316 -0.865 . . . . 0.0 111.028 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.534 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 19.4 mmtp -68.43 -8.81 43.99 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 178.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -133.76 -12.89 2.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.783 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 52.68 45.83 27.89 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -178.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 t -111.86 -173.61 2.28 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.311 0.577 . . . . 0.0 109.732 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.51 5.66 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 177.551 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 35.2 mt -59.81 82.6 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.047 0 O-C-N 120.661 -1.274 . . . . 0.0 110.745 -176.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.553 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -115.38 4.62 14.4 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.539 ' NZ ' ' OH ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -80.59 72.08 7.49 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.425 ' O ' ' O ' ' A' ' 76' ' ' HIS . 46.5 m -44.74 -53.09 7.72 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.204 -0.935 . . . . 0.0 109.742 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.518 ' CE1' ' HG ' ' B' ' 605' ' ' CYS . 45.5 m-70 -51.9 -179.31 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.362 -0.836 . . . . 0.0 109.134 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 23.3 m0 55.92 173.65 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 121.741 0.781 . . . . 0.0 109.124 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.692 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -131.2 -164.6 1.46 Allowed 'General case' 0 N--CA 1.494 1.755 0 CA-C-O 121.681 0.753 . . . . 0.0 109.24 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.563 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.1 mp -70.68 -58.4 3.69 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -43.77 -52.4 6.64 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.67 0.748 . . . . 0.0 109.702 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.692 ' CG ' ' H ' ' A' ' 78' ' ' THR . 41.0 mmtt -46.11 -54.43 8.59 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.628 0.727 . . . . 0.0 109.558 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.539 ' OH ' ' NZ ' ' A' ' 74' ' ' LYS . 2.2 m-85 -72.59 -42.05 64.98 Favored 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.785 -0.766 . . . . 0.0 109.143 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.19 6.1 14.07 Favored Glycine 0 N--CA 1.5 2.966 0 N-CA-C 108.418 -1.873 . . . . 0.0 108.418 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.515 HG22 ' N ' ' A' ' 85' ' ' GLN . 52.0 mt -61.63 161.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 O-C-N 121.765 -0.844 . . . . 0.0 109.784 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.515 ' N ' HG22 ' A' ' 84' ' ' ILE . 0.0 OUTLIER -172.05 -162.91 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.0 -32.19 70.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.368 -0.832 . . . . 0.0 109.956 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.416 ' OD2' ' O ' ' A' ' 87' ' ' ASP . 1.0 OUTLIER -68.42 -13.19 62.12 Favored 'General case' 0 C--N 1.296 -1.724 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.477 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -96.81 112.56 24.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -96.23 116.21 28.64 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.928 -1.107 . . . . 0.0 109.594 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.516 ' HG ' HD12 ' A' ' 20' ' ' LEU . 6.8 mt -91.99 175.73 6.76 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.514 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 6.7 mt-30 -134.68 160.34 38.44 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.651 ' CZ ' ' CZ3' ' A' ' 58' ' ' TRP . 0.1 OUTLIER -119.16 96.45 5.23 Favored 'General case' 0 N--CA 1.502 2.152 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 177.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -136.96 163.35 50.04 Favored Pre-proline 0 N--CA 1.503 2.197 0 O-C-N 121.858 -0.526 . . . . 0.0 110.266 -177.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.493 1.46 0 C-N-CA 122.927 2.418 . . . . 0.0 111.945 179.246 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -76.86 -75.43 0.2 Allowed 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.219 -0.926 . . . . 0.0 109.83 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.416 ' O ' ' O ' ' B' ' 544' ' ' ARG . 2.3 pt-20 -163.83 16.66 0.06 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.293 -0.879 . . . . 0.0 109.628 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.442 ' N ' ' CD ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER 51.17 94.57 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.288 -0.883 . . . . 0.0 108.931 -179.473 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.613 ' CD ' ' H ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -44.56 -45.33 9.33 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.753 -0.592 . . . . 0.0 110.531 -178.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -78.5 -135.6 0.99 Allowed Glycine 0 N--CA 1.487 2.072 0 C-N-CA 119.432 -1.366 . . . . 0.0 110.606 -178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.668 ' H ' ' H ' ' B' ' 556' ' ' ILE . 1.7 m -165.99 119.95 1.16 Allowed 'General case' 0 C--N 1.298 -1.669 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.6 mp -58.45 133.81 56.1 Favored 'General case' 0 C--N 1.293 -1.85 0 O-C-N 120.696 -1.253 . . . . 0.0 110.74 -177.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.499 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.61 104.08 13.44 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 105.883 -1.895 . . . . 0.0 105.883 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.1 t -50.84 126.66 16.51 Favored 'General case' 0 C--N 1.298 -1.658 0 CA-C-O 122.23 1.014 . . . . 0.0 109.728 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.37 5.5 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 106.216 -2.753 . . . . 0.0 106.216 -177.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.7 m -105.72 -36.15 7.15 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.453 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.8 mm-40 55.65 56.2 6.42 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-O 122.719 1.247 . . . . 0.0 110.015 -178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -140.63 123.92 10.15 Favored Pre-proline 0 N--CA 1.497 1.88 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -44.07 133.94 8.52 Favored 'Trans proline' 0 N--CA 1.491 1.331 0 CA-C-N 120.536 1.227 . . . . 0.0 114.488 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.668 ' H ' ' H ' ' B' ' 547' ' ' SER . 36.9 mt -91.85 98.53 8.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -99.77 92.13 5.17 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.203 -0.936 . . . . 0.0 111.338 -178.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.27 -95.24 0.15 Allowed Glycine 0 N--CA 1.488 2.118 0 N-CA-C 107.443 -2.263 . . . . 0.0 107.443 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 10.0 mmt180 -114.2 151.13 33.23 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.1 p -144.45 126.25 15.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.944 -1.097 . . . . 0.0 111.676 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 41.0 mt -91.43 146.77 5.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.633 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.679 ' H ' ' HZ2' ' B' ' 584' ' ' LYS . 8.6 m -117.61 146.6 43.53 Favored 'General case' 0 C--N 1.293 -1.861 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.709 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.2 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.61 0.719 . . . . 0.0 109.389 -178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.549 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.9 mtp -65.96 26.44 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.709 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.12 -8.96 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 -178.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -82.14 161.92 22.65 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -103.77 174.66 5.77 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -161.09 135.07 6.89 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 118.03 -1.468 . . . . 0.0 110.089 -179.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.586 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.8 m80 -55.53 116.0 10.79 Favored Pre-proline 0 C--N 1.301 -1.533 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 177.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.53 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 41.8 Cg_exo -46.46 -9.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.384 0 CA-C-N 120.27 1.132 . . . . 0.0 111.642 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.677 ' O ' HG13 ' B' ' 574' ' ' VAL . 10.4 mt-10 -99.75 -52.41 3.46 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 122.418 1.104 . . . . 0.0 109.738 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 17.6 m170 -59.06 -3.2 0.33 Allowed 'General case' 0 C--N 1.289 -2.028 0 O-C-N 120.41 -1.432 . . . . 0.0 109.618 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.48 ' H ' ' C ' ' B' ' 571' ' ' GLU . 23.2 t80 -132.38 58.86 1.74 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.677 HG13 ' O ' ' B' ' 571' ' ' GLU . 7.7 m -93.91 177.98 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.659 0.742 . . . . 0.0 110.777 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.617 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -75.52 145.64 41.17 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 179.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.95 75.7 3.11 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 116.661 -2.015 . . . . 0.0 109.935 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . 0.429 ' HE2' HG21 ' A' ' 49' ' ' VAL . 0.9 OUTLIER -153.1 -61.61 0.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 102.264 -3.236 . . . . 0.0 102.264 173.05 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.542 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.3 p -118.41 82.78 1.9 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 111.881 -2.418 . . . . 0.0 105.069 176.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.1 mp -52.66 16.36 0.0 OUTLIER 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -176.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.75 -36.82 21.5 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 119.573 -1.954 . . . . 0.0 112.78 -178.153 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.53 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.2 tp60 -161.9 142.13 10.33 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 119.262 -2.149 . . . . 0.0 114.941 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.617 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.5 tp -140.38 167.63 21.7 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 175.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.526 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.7 m-20 -150.8 134.78 16.73 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.236 -0.915 . . . . 0.0 109.235 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.679 ' HZ2' ' H ' ' B' ' 562' ' ' THR . 1.8 ptpp? -52.58 -18.65 1.84 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.229 -0.919 . . . . 0.0 109.292 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.46 -18.19 57.43 Favored Glycine 0 N--CA 1.485 1.938 0 N-CA-C 108.761 -1.736 . . . . 0.0 108.761 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.4 p -135.68 25.17 3.4 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.906 -0.761 . . . . 0.0 108.989 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.554 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -91.08 109.08 20.32 Favored 'General case' 0 N--CA 1.501 2.078 0 CA-C-O 122.564 1.173 . . . . 0.0 110.029 179.791 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -105.7 169.91 8.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 107.516 -1.291 . . . . 0.0 107.516 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.425 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.2 tt0 -152.62 157.19 40.63 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.737 -1.227 . . . . 0.0 110.616 -178.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.503 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -157.1 146.52 20.35 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 106.318 -1.734 . . . . 0.0 106.318 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.606 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 47.89 22.93 0.41 Allowed 'General case' 0 C--N 1.297 -1.711 0 O-C-N 120.923 -1.11 . . . . 0.0 109.59 -179.323 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.473 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 81.81 -7.03 1.43 Allowed 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.789 -0.57 . . . . 0.0 111.234 178.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . 0.402 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 38.3 mttm -89.59 121.07 69.5 Favored Pre-proline 0 C--N 1.297 -1.711 0 O-C-N 121.033 -1.042 . . . . 0.0 109.711 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.537 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.5 Cg_exo -49.61 164.18 0.38 Allowed 'Trans proline' 0 N--CA 1.489 1.235 0 CA-C-N 120.174 1.098 . . . . 0.0 111.656 178.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.537 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.6 m-85 -170.28 139.95 1.81 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.242 -0.911 . . . . 0.0 109.873 -179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 3.8 m -69.69 154.08 42.49 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 175.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.537 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.09 -57.59 12.39 Favored 'General case' 0 C--N 1.294 -1.821 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 178.357 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.8 -29.68 1.41 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 4.6 m -82.43 -67.55 0.78 Allowed 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.639 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.32 -59.16 3.1 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 121.523 0.678 . . . . 0.0 110.224 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.65 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -50.44 -42.7 54.53 Favored 'General case' 0 C--N 1.293 -1.851 0 O-C-N 121.539 -0.725 . . . . 0.0 109.429 -178.567 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 8.7 tptp -62.78 -22.84 66.89 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.089 -1.007 . . . . 0.0 111.199 -179.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.468 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -92.92 -44.69 8.32 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.325 -1.484 . . . . 0.0 110.26 -179.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.447 ' O ' ' C ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -120.06 32.85 5.85 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.528 -0.733 . . . . 0.0 109.831 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.518 ' HG ' ' CE1' ' A' ' 76' ' ' HIS . 0.8 OUTLIER . . . . . 0 N--CA 1.503 2.2 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.624 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.624 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -143.37 -55.09 0.39 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.116 -0.99 . . . . 0.0 108.607 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.5 mt -43.9 -80.43 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.294 1.045 . . . . 0.0 109.435 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.433 ' C ' ' N ' ' A' ' 6' ' ' ILE . 17.0 t70 52.86 14.45 0.44 Allowed 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.836 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.49 -12.95 35.34 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 106.727 -2.549 . . . . 0.0 106.727 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.659 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -112.5 -107.54 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 -179.834 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.424 ' HB3' ' H ' ' A' ' 8' ' ' MET . 4.4 tpp180 -172.31 -90.13 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.16 0 O-C-N 120.846 -1.159 . . . . 0.0 111.494 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.555 ' O ' ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -120.33 -54.04 0.04 OUTLIER Pre-proline 0 N--CA 1.501 2.088 0 O-C-N 121.844 -0.535 . . . . 0.0 112.215 -176.351 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -58.67 -40.28 74.76 Favored 'Trans proline' 0 N--CA 1.5 1.861 0 C-N-CA 121.686 1.591 . . . . 0.0 111.496 -179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -112.71 -23.25 10.29 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.62 -4.55 90.19 Favored Glycine 0 N--CA 1.484 1.852 0 N-CA-C 108.271 -1.932 . . . . 0.0 108.271 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 9.0 t -173.66 -85.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.503 -0.998 . . . . 0.0 109.744 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.555 ' N ' ' O ' ' A' ' 8' ' ' MET . 11.6 t80 -176.57 -65.79 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -172.54 -48.95 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -146.2 2.9 0.89 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.432 -0.792 . . . . 0.0 109.431 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.03 16.4 41.42 Favored Glycine 0 N--CA 1.494 2.502 0 N-CA-C 108.542 -1.823 . . . . 0.0 108.542 -179.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.5 p -93.92 122.07 36.04 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.551 -0.97 . . . . 0.0 109.475 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.441 ' HE1' ' N ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -125.78 123.51 38.94 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.617 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.23 129.99 34.9 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 108.807 -179.806 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.446 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.34 131.46 35.06 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.66 34.68 Favored 'General case' 0 C--N 1.296 -1.724 0 O-C-N 121.287 -0.883 . . . . 0.0 110.098 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 33.1 t -136.39 106.96 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 CA-C-O 121.67 0.747 . . . . 0.0 109.21 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.502 ' NE2' ' OD2' ' A' ' 30' ' ' ASP . 5.9 m170 -77.81 103.43 7.75 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 178.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.564 HG13 ' CD1' ' A' ' 92' ' ' PHE . 2.1 t -69.35 107.38 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.621 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 27' ' ' LEU . 11.5 p -74.27 -65.31 0.86 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.542 -0.724 . . . . 0.0 111.122 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' OG1' ' A' ' 25' ' ' THR . 19.3 t0 -46.9 -13.15 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.088 -1.007 . . . . 0.0 110.027 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.549 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 4.5 mm? -112.12 -48.03 3.07 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.424 -0.797 . . . . 0.0 109.062 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER 98.02 13.06 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -177.531 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.426 HH21 ' HB2' ' A' ' 29' ' ' ARG . 5.1 mtp-105 -94.77 -176.85 4.0 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.125 0.965 . . . . 0.0 109.702 -179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.502 ' OD2' ' NE2' ' A' ' 23' ' ' HIS . 2.4 m-20 -138.34 116.02 11.41 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.438 HG12 ' N ' ' A' ' 32' ' ' THR . 42.6 t -113.15 155.96 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-O 121.532 0.682 . . . . 0.0 109.341 -179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -134.56 133.92 40.79 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.551 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD22 ' O ' ' A' ' 32' ' ' THR . 2.7 mm? -113.85 113.16 24.51 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -60.26 107.58 0.67 Allowed 'General case' 0 C--N 1.301 -1.512 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.4 m -134.5 -169.77 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.822 0.82 . . . . 0.0 110.114 -179.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.9 p -142.61 173.25 11.7 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.441 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -78.89 46.61 2.95 Favored Glycine 0 N--CA 1.484 1.867 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' C ' HG21 ' A' ' 78' ' ' THR . 6.4 pt-20 -148.57 4.89 0.69 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.675 -0.897 . . . . 0.0 108.982 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.615 ' O ' HG22 ' A' ' 78' ' ' THR . 2.3 m -90.49 144.31 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.01 -1.057 . . . . 0.0 110.174 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.492 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 p-80 -84.47 146.45 27.6 Favored 'General case' 0 C--N 1.296 -1.731 0 O-C-N 120.924 -1.11 . . . . 0.0 108.797 178.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 68.3 mt -48.93 -53.68 6.95 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 120.937 -1.102 . . . . 0.0 108.683 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.72 -15.32 4.49 Favored Glycine 0 N--CA 1.485 1.945 0 N-CA-C 108.148 -1.981 . . . . 0.0 108.148 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -76.85 -30.62 55.67 Favored Glycine 0 N--CA 1.483 1.777 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.9 t -83.71 -43.47 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.61 -0.935 . . . . 0.0 108.62 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.58 -37.67 12.87 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.112 -0.992 . . . . 0.0 108.389 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -70.21 -61.06 1.92 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.657 -0.652 . . . . 0.0 110.301 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -53.89 -59.22 4.91 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.178 -0.952 . . . . 0.0 111.663 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 30.4 tp -45.18 -44.3 10.76 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.072 -1.017 . . . . 0.0 110.088 -177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 52' ' ' LEU . 24.6 t -70.89 -46.76 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.138 -0.976 . . . . 0.0 109.418 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -44.7 -37.75 3.92 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.31 -0.869 . . . . 0.0 109.646 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.487 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 7.8 mtmp? -71.46 -33.8 69.65 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.446 -0.784 . . . . 0.0 109.585 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' A' ' 49' ' ' VAL . 4.1 tp -64.01 -67.9 0.39 Allowed 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.0 t70 67.03 78.76 0.24 Allowed 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.807 0.813 . . . . 0.0 110.572 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.569 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -171.9 149.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.068 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.623 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.46 33.97 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.264 -0.897 . . . . 0.0 109.028 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.569 ' H ' ' C ' ' A' ' 54' ' ' VAL . 43.3 tttp -78.07 164.55 24.93 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.313 -0.867 . . . . 0.0 109.146 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.14 91.57 4.34 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.358 -0.838 . . . . 0.0 109.154 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 18.2 m0 -72.35 -52.05 17.87 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.343 -0.848 . . . . 0.0 108.783 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.566 ' C ' ' H ' ' A' ' 61' ' ' HIS . 76.1 p -47.82 -41.84 24.76 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.62 -0.675 . . . . 0.0 110.008 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -53.99 -4.83 0.06 Allowed 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.25 -0.907 . . . . 0.0 109.091 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.596 ' CG ' ' CE2' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -119.12 161.62 20.0 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-O 122.008 0.909 . . . . 0.0 110.129 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . . . -169.99 165.56 9.45 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.76 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.9 mm? -93.35 132.88 37.16 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.603 -1.311 . . . . 0.0 109.637 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.482 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -119.73 147.85 44.1 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -179.618 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.553 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -108.29 93.0 4.29 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.112 -0.992 . . . . 0.0 108.551 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -54.95 -24.12 22.35 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.243 -0.911 . . . . 0.0 110.895 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.538 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 26.0 mmtt -68.58 -8.28 40.31 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 178.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -133.86 -12.75 2.56 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.553 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.9 OUTLIER 52.86 45.77 28.1 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -178.236 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -113.02 -173.2 2.2 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.423 0.63 . . . . 0.0 109.914 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.71 98.61 5.05 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 177.082 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.417 ' HB3' HD13 ' A' ' 41' ' ' ILE . 21.6 mt -60.67 82.98 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 O-C-N 120.86 -1.15 . . . . 0.0 110.449 -176.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -117.79 6.84 12.35 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.424 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -84.11 68.78 10.22 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.759 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.414 ' C ' ' O ' ' A' ' 74' ' ' LYS . 28.4 m -40.84 -38.5 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.542 -0.724 . . . . 0.0 110.073 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 15.4 m80 -58.72 171.45 0.64 Allowed 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.266 -0.896 . . . . 0.0 108.964 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 16.7 m0 56.51 168.17 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.61 0.719 . . . . 0.0 109.737 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.665 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -121.7 -164.48 1.15 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 121.693 0.758 . . . . 0.0 109.477 -178.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 79' ' ' LEU . 4.8 mp -70.41 -59.44 2.86 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -42.82 -51.91 5.25 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.833 0.825 . . . . 0.0 109.755 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.665 ' CG ' ' H ' ' A' ' 78' ' ' THR . 23.0 mmtp -47.16 -54.68 10.05 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.742 0.782 . . . . 0.0 109.362 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.21 -43.37 74.26 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 120.066 -0.654 . . . . 0.0 109.345 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.77 4.23 17.24 Favored Glycine 0 N--CA 1.499 2.843 0 N-CA-C 108.176 -1.97 . . . . 0.0 108.176 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.535 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 45.4 mt -61.55 161.21 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.505 0 O-C-N 121.772 -0.84 . . . . 0.0 109.331 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.535 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -173.15 -166.29 0.34 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.463 -0.773 . . . . 0.0 109.134 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.38 -22.83 64.63 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.409 -0.807 . . . . 0.0 109.968 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -77.41 -11.37 59.83 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.446 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.03 113.03 25.34 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 15.9 mmtp -97.08 118.09 32.72 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.095 -1.003 . . . . 0.0 109.541 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.9 mt -94.63 177.13 6.02 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.482 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 4.8 mt-30 -132.89 158.61 42.12 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.329 -1.359 . . . . 0.0 107.329 179.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.596 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -101.33 109.35 21.18 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 178.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 62' ' ' ALA . 0.4 OUTLIER -162.17 158.78 21.08 Favored Pre-proline 0 N--CA 1.495 1.806 0 O-C-N 120.555 -1.34 . . . . 0.0 109.459 -177.67 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo . . . . . 0 N--CA 1.492 1.391 0 C-N-CA 122.471 2.114 . . . . 0.0 111.744 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -67.01 -109.97 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.141 -0.974 . . . . 0.0 110.051 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.415 ' HG2' ' H ' ' B' ' 543' ' ' GLU . 0.1 OUTLIER -45.44 -24.8 0.34 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.307 -0.871 . . . . 0.0 109.603 -179.562 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.45 ' HD3' ' H ' ' B' ' 544' ' ' ARG . 0.0 OUTLIER -81.35 118.33 22.56 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.179 -0.951 . . . . 0.0 109.007 179.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.48 ' N ' ' CD ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -132.64 -33.86 1.2 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.523 -0.736 . . . . 0.0 109.884 -178.705 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . 0.474 ' O ' ' O ' ' B' ' 545' ' ' ARG . . . -52.2 -110.98 0.01 OUTLIER Glycine 0 N--CA 1.496 2.655 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.534 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m -165.7 118.52 1.13 Allowed 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -59.96 135.57 57.75 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 120.938 -1.102 . . . . 0.0 110.431 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.485 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.58 103.93 13.3 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 178.196 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.3 t -51.28 127.08 18.58 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.245 1.021 . . . . 0.0 109.727 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.6 -34.79 5.27 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 106.206 -2.758 . . . . 0.0 106.206 -177.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.5 m -105.4 -35.93 7.34 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.448 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.9 mm-40 55.92 56.49 5.96 Favored 'General case' 0 C--N 1.3 -1.557 0 CA-C-O 122.694 1.235 . . . . 0.0 110.079 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp -140.47 123.6 10.14 Favored Pre-proline 0 N--CA 1.496 1.84 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_exo -44.2 134.99 8.66 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 CA-C-N 120.519 1.221 . . . . 0.0 114.743 -178.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.1 mt -94.22 98.29 7.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.6 p -99.85 91.17 4.7 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.218 -0.926 . . . . 0.0 111.25 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.77 -95.9 0.15 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 107.584 -2.206 . . . . 0.0 107.584 179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.474 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 11.5 mmt180 -112.48 151.31 30.08 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 22.3 p -144.77 126.29 15.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.957 -1.089 . . . . 0.0 111.438 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.97 146.65 5.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.886 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.4 m -118.28 146.78 44.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-O 121.853 0.835 . . . . 0.0 109.158 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.741 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.69 -129.11 0.26 Allowed 'General case' 0 C--N 1.295 -1.787 0 CA-C-O 121.601 0.715 . . . . 0.0 109.441 -178.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 8.4 mtp -65.75 26.07 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.741 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.14 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 106.627 -1.62 . . . . 0.0 106.627 -177.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.95 162.67 22.61 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -104.87 174.56 5.82 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.24 134.0 7.09 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.417 -1.427 . . . . 0.0 110.24 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.6 m80 -54.04 114.09 5.98 Favored Pre-proline 0 C--N 1.303 -1.443 0 N-CA-C 105.782 -1.933 . . . . 0.0 105.782 176.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.585 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 37.0 Cg_exo -46.85 -11.45 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.381 1.172 . . . . 0.0 111.218 -178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.897 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.7 mt-10 -95.43 -51.79 4.42 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 122.046 0.927 . . . . 0.0 110.185 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.471 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.1 m170 -60.21 -3.56 0.64 Allowed 'General case' 0 C--N 1.294 -1.831 0 O-C-N 120.982 -1.074 . . . . 0.0 109.859 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.42 ' H ' ' C ' ' B' ' 571' ' ' GLU . 24.2 t80 -130.31 57.95 1.69 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.897 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.32 178.04 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-O 121.74 0.781 . . . . 0.0 111.167 -178.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.664 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.93 145.35 30.36 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.169 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -93.56 75.48 4.4 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.794 -1.962 . . . . 0.0 109.239 178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -153.46 -64.74 0.15 Allowed 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 102.163 -3.273 . . . . 0.0 102.163 173.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.555 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -114.28 79.43 1.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 111.897 -2.411 . . . . 0.0 104.583 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 9.4 mt -52.86 16.0 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.555 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.84 -36.61 15.93 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 119.739 -1.851 . . . . 0.0 112.459 -178.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.585 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.1 tp60 -158.83 140.1 13.13 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 119.562 -1.961 . . . . 0.0 114.822 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.664 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.1 tp -137.94 169.51 17.66 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.435 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.2 m-20 -148.0 130.79 16.06 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.285 -0.884 . . . . 0.0 109.041 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.886 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 0.6 OUTLIER -52.13 -17.2 0.99 Allowed 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.432 -0.793 . . . . 0.0 109.606 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.39 -20.6 51.54 Favored Glycine 0 N--CA 1.485 1.909 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.24 27.59 4.13 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.85 108.78 19.91 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 122.589 1.185 . . . . 0.0 109.979 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.506 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -101.51 168.22 9.64 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.72 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.431 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.95 157.29 40.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.707 -1.246 . . . . 0.0 110.693 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.542 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 3.2 tp60 -155.25 145.96 22.28 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.532 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.0 23.66 0.09 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.09 -1.006 . . . . 0.0 109.97 -179.754 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 83.43 -6.48 1.17 Allowed 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.828 -0.545 . . . . 0.0 110.869 178.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -88.0 118.68 69.92 Favored Pre-proline 0 C--N 1.294 -1.816 0 O-C-N 121.279 -0.888 . . . . 0.0 109.559 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.513 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 37.0 Cg_exo -49.41 165.58 0.24 Allowed 'Trans proline' 0 N--CA 1.489 1.209 0 CA-C-N 120.089 1.067 . . . . 0.0 111.808 179.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.513 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.9 m-85 -170.82 137.66 1.29 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.133 -0.979 . . . . 0.0 110.473 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 28.5 m -70.36 155.63 40.41 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 104.247 -2.501 . . . . 0.0 104.247 174.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.569 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.11 -57.55 12.55 Favored 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 117.563 -1.655 . . . . 0.0 107.001 179.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.77 -29.77 1.42 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.446 -0.784 . . . . 0.0 109.565 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 89.9 m -80.04 -65.62 0.98 Allowed 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.288 -0.882 . . . . 0.0 108.791 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.578 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.68 -55.86 17.02 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.751 -0.593 . . . . 0.0 110.048 -179.776 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.692 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -47.06 -39.08 12.22 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.296 -0.877 . . . . 0.0 108.792 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt -67.91 -20.38 65.08 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.57 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 9.6 mt -90.66 -56.84 3.04 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.542 -1.349 . . . . 0.0 111.937 -178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.542 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 6.2 m-85 -91.61 -29.24 17.02 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.672 -1.268 . . . . 0.0 110.351 -178.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.422 ' O ' HD12 ' B' ' 601' ' ' LEU . 74.2 m . . . . . 0 N--CA 1.501 2.091 0 CA-C-O 118.062 -0.971 . . . . 0.0 109.448 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.5 ttm . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -152.3 -54.03 0.12 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.119 -0.988 . . . . 0.0 108.78 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.485 ' C ' ' N ' ' A' ' 5' ' ' GLY . 2.3 mp -45.77 -80.3 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.844 0.831 . . . . 0.0 110.426 179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' CG ' ' O ' ' A' ' 4' ' ' ASP . 19.4 t70 49.6 18.1 0.28 Allowed 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 -178.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.485 ' N ' ' C ' ' A' ' 3' ' ' LEU . . . -70.95 -8.46 64.37 Favored Glycine 0 N--CA 1.486 2.014 0 N-CA-C 108.443 -1.863 . . . . 0.0 108.443 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.626 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -114.74 -105.09 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.296 -1.732 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -178.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.51 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -151.76 -96.38 0.06 Allowed 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.594 -1.316 . . . . 0.0 109.882 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.546 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -142.13 -61.78 0.02 OUTLIER Pre-proline 0 N--CA 1.501 2.108 0 O-C-N 121.026 -1.046 . . . . 0.0 110.468 -179.503 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -44.8 -29.63 3.71 Favored 'Trans proline' 0 N--CA 1.494 1.538 0 CA-C-N 121.329 1.51 . . . . 0.0 109.786 178.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -119.59 -23.67 6.5 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.194 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.84 -1.37 76.91 Favored Glycine 0 N--CA 1.489 2.181 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.546 ' N ' ' O ' ' A' ' 8' ' ' MET . 30.1 t -169.43 -7.85 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.154 -1.204 . . . . 0.0 111.248 -179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.665 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 14.2 m-85 68.78 -80.01 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.222 -0.923 . . . . 0.0 108.885 -179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.665 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 166.21 -39.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.458 -0.776 . . . . 0.0 109.144 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -140.91 -0.57 1.48 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.462 -0.773 . . . . 0.0 109.577 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 88.52 31.86 12.64 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.091 -1.604 . . . . 0.0 109.091 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 p -85.46 122.83 30.16 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 121.435 -1.038 . . . . 0.0 109.274 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.417 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -131.79 123.15 27.02 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 179.258 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.14 129.82 35.62 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.128 -0.982 . . . . 0.0 108.592 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.504 HD21 HG22 ' A' ' 84' ' ' ILE . 0.1 OUTLIER -83.31 131.57 35.07 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -77.85 145.63 36.17 Favored 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.444 -0.903 . . . . 0.0 109.296 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.1 t -138.93 113.53 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 CA-C-O 121.868 0.842 . . . . 0.0 109.909 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.508 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 7.6 m170 -85.83 103.5 14.64 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.525 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -72.44 99.3 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.415 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 27' ' ' LEU . 59.2 p -73.67 -38.3 64.99 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.533 -0.729 . . . . 0.0 109.968 -178.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -73.41 18.16 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.061 -1.024 . . . . 0.0 108.627 179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.9 mt -152.03 -30.53 0.16 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.525 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 84.7 13.61 0.24 Allowed 'General case' 0 N--CA 1.498 1.973 0 O-C-N 122.248 -0.282 . . . . 0.0 110.351 -179.784 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -98.42 -178.2 3.94 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 120.954 -1.091 . . . . 0.0 109.952 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.508 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 32.1 m-20 -138.97 117.57 12.16 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.41 HG12 ' N ' ' A' ' 32' ' ' THR . 20.9 t -117.97 157.3 19.36 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-O 121.629 0.728 . . . . 0.0 110.096 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.443 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.79 135.33 43.79 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 179.686 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.538 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 2.4 mm? -116.51 112.29 21.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.566 -0.709 . . . . 0.0 109.336 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -60.66 103.92 0.3 Allowed 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.414 ' HB ' HG11 ' A' ' 39' ' ' VAL . 22.1 m -136.28 -170.64 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-O 121.972 0.891 . . . . 0.0 110.338 -178.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.417 ' OG1' ' CG ' ' A' ' 38' ' ' GLU . 5.6 p -143.06 176.3 9.2 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.6 45.72 2.94 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.148 -1.581 . . . . 0.0 109.148 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' C ' HG21 ' A' ' 78' ' ' THR . 3.2 pt-20 -144.97 -0.13 0.92 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.295 -1.121 . . . . 0.0 108.605 179.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.455 ' O ' HG22 ' A' ' 78' ' ' THR . 1.7 m -87.89 134.11 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 O-C-N 121.006 -1.059 . . . . 0.0 109.81 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.514 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.3 m-70 -69.61 139.41 53.62 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 121.1 -1.0 . . . . 0.0 108.823 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.436 ' C ' ' N ' ' A' ' 43' ' ' GLY . 14.7 mt -47.31 -58.55 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.151 -0.968 . . . . 0.0 109.322 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.454 ' H ' HG22 ' A' ' 75' ' ' THR . . . -55.51 -13.19 5.38 Favored Glycine 0 C--N 1.299 -1.519 0 N-CA-C 108.219 -1.952 . . . . 0.0 108.219 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.84 -24.95 73.02 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.248 -1.941 . . . . 0.0 108.248 178.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 6.4 t -83.67 -38.5 14.23 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.482 ' O ' HG23 ' A' ' 49' ' ' VAL . 31.6 mtm -48.41 -37.39 16.88 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.426 ' CD1' HD13 ' B' ' 603' ' ' LEU . 2.1 tp -73.57 -61.27 1.89 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.738 -0.602 . . . . 0.0 110.788 -178.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -53.49 -61.27 2.41 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.214 -0.929 . . . . 0.0 110.889 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 41.6 tp -49.74 -35.06 20.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.277 -0.889 . . . . 0.0 109.416 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 45' ' ' MET . 9.2 t -73.02 -48.6 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.33 -0.856 . . . . 0.0 108.767 179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -44.71 -37.44 3.72 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.536 -0.727 . . . . 0.0 109.559 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.538 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 55.5 mttp -71.16 -34.75 71.27 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.449 -0.782 . . . . 0.0 110.355 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.46 HD12 ' CG1' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -61.73 -63.24 1.33 Allowed 'General case' 0 C--N 1.306 -1.283 0 O-C-N 120.953 -1.092 . . . . 0.0 109.062 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.7 t70 69.54 78.3 0.21 Allowed 'General case' 0 N--CA 1.487 1.417 0 CA-C-O 121.884 0.85 . . . . 0.0 109.895 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.553 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -171.51 147.42 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.957 0 C-N-CA 119.951 -0.699 . . . . 0.0 110.391 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -68.96 35.37 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.444 -0.785 . . . . 0.0 108.959 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.553 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.4 ttmm -78.34 154.64 30.65 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.12 -0.988 . . . . 0.0 108.817 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.22 97.75 0.75 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 108.767 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.541 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 45.7 m0 -80.45 -45.19 18.01 Favored 'General case' 0 C--N 1.296 -1.742 0 O-C-N 121.809 -0.557 . . . . 0.0 110.095 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.2 t -56.39 -56.61 19.03 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.995 -1.066 . . . . 0.0 110.399 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.426 ' OD1' ' O ' ' A' ' 94' ' ' PRO . 16.3 t70 -49.83 -24.63 2.53 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.16 -0.963 . . . . 0.0 108.881 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.541 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -73.36 148.17 43.66 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.961 0.886 . . . . 0.0 109.731 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -160.68 152.6 19.94 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.826 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -94.79 143.06 26.76 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.141 -0.975 . . . . 0.0 109.716 -179.088 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.531 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.23 137.4 52.88 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.503 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.5 t90 -95.77 89.78 5.42 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.589 -0.694 . . . . 0.0 109.425 -179.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.477 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 14.4 pt-20 -53.98 -23.78 14.39 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.176 -0.952 . . . . 0.0 110.298 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.497 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.5 mmtp -63.91 -10.8 22.95 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.471 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -134.95 -12.3 2.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.212 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.6 44.95 29.07 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -110.03 -174.15 2.42 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.515 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.92 99.6 5.58 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 177.529 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.6 mt -59.88 83.75 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.053 0 CA-C-O 122.361 1.077 . . . . 0.0 110.662 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -121.5 6.69 10.07 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.133 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.444 ' CB ' ' NZ ' ' A' ' 81' ' ' LYS . 0.0 OUTLIER -78.73 74.04 5.27 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.21 -0.931 . . . . 0.0 109.542 -179.472 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.562 HG21 ' O ' ' B' ' 602' ' ' LYS . 11.8 p -75.93 -18.55 59.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.285 -0.884 . . . . 0.0 109.882 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -76.76 36.54 0.17 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.117 -0.989 . . . . 0.0 110.25 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -175.57 -143.81 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.504 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -152.96 149.53 28.31 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 119.851 -1.781 . . . . 0.0 109.506 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.681 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.3 pt? -40.2 -48.63 2.59 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.196 -0.94 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.423 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 18.0 t70 -47.23 -33.46 5.47 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.171 -0.956 . . . . 0.0 109.574 177.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.563 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.73 -31.08 70.77 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.563 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -79.02 -50.93 10.3 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 178.629 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.1 9.39 6.13 Favored Glycine 0 N--CA 1.509 3.562 0 N-CA-C 108.898 -1.681 . . . . 0.0 108.898 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.546 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 56.4 mt -60.63 161.35 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.963 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.546 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.47 -168.68 1.57 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.255 -0.903 . . . . 0.0 109.074 179.176 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.34 -23.04 65.58 Favored 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.284 -0.885 . . . . 0.0 110.157 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -2.24 56.99 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.196 -0.94 . . . . 0.0 108.908 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.481 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.37 113.03 25.12 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.527 -0.733 . . . . 0.0 109.641 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 18.8 mmtp -98.32 115.55 28.67 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.995 -1.066 . . . . 0.0 109.741 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.7 mt -95.38 176.11 6.32 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -133.58 156.63 47.48 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.538 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 2.2 t80 -115.21 126.4 54.51 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 178.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.19 159.06 26.71 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 120.992 -1.068 . . . . 0.0 110.274 -178.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . 0.426 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 9.6 Cg_endo . . . . . 0 N--CA 1.497 1.694 0 C-N-CA 122.789 2.326 . . . . 0.0 111.735 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . 0.449 ' O ' ' CD1' ' B' ' 541' ' ' TYR . 58.7 t80 . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . 0.577 ' CD2' ' N ' ' B' ' 542' ' ' HIS . 2.4 m170 -63.86 -152.94 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.304 -0.872 . . . . 0.0 109.587 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.409 ' HG3' HH21 ' B' ' 544' ' ' ARG . 0.1 OUTLIER -163.83 -80.99 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.279 -0.888 . . . . 0.0 109.295 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.409 HH21 ' HG3' ' B' ' 543' ' ' GLU . 10.5 mpt_? 38.84 32.02 0.05 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.726 -0.609 . . . . 0.0 110.616 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.526 ' HD2' ' H ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -52.84 -76.24 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.262 -0.899 . . . . 0.0 108.773 179.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -167.07 -99.08 0.13 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.536 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m -169.56 118.22 0.63 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -58.15 135.67 57.1 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.893 -1.129 . . . . 0.0 110.375 -178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.53 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.01 104.12 13.82 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 178.467 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.52 125.4 11.24 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 122.077 0.941 . . . . 0.0 109.695 -178.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -33.86 5.83 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 106.569 -2.612 . . . . 0.0 106.569 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.1 m -106.3 -35.52 7.13 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 54.97 56.65 6.38 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.793 1.283 . . . . 0.0 109.937 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -140.66 123.77 10.04 Favored Pre-proline 0 C--N 1.295 -1.78 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 177.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -44.1 134.03 8.57 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 CA-C-N 120.461 1.2 . . . . 0.0 114.674 -178.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.536 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.2 mt -92.65 98.37 8.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.9 p -99.71 91.16 4.73 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.301 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.1 -96.01 0.15 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.433 -2.267 . . . . 0.0 107.433 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.48 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -113.2 150.9 31.66 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 106.983 -1.488 . . . . 0.0 106.983 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.53 126.48 15.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.0 -1.062 . . . . 0.0 111.384 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.3 mt -90.57 146.21 6.47 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.583 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 11.3 m -121.21 146.4 46.84 Favored 'General case' 0 C--N 1.29 -1.98 0 CA-C-O 121.982 0.896 . . . . 0.0 108.968 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.734 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -124.56 -127.9 0.25 Allowed 'General case' 0 C--N 1.291 -1.973 0 CA-C-O 122.092 0.949 . . . . 0.0 108.783 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 0.0 OUTLIER -65.51 28.1 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.089 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.734 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 103.43 -8.07 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 -177.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 149.64 26.75 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -95.69 174.86 6.77 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -160.36 134.02 6.99 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 118.289 -1.365 . . . . 0.0 110.077 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.59 ' O ' ' N ' ' B' ' 571' ' ' GLU . 6.0 m80 -55.65 115.84 10.49 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 105.482 -2.044 . . . . 0.0 105.482 177.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 53.0 Cg_exo -45.32 -9.5 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.43 0 CA-C-N 120.298 1.142 . . . . 0.0 112.141 -178.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.931 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.3 mt-10 -102.03 -52.55 3.14 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 122.059 0.933 . . . . 0.0 109.978 179.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.452 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 16.7 m170 -56.88 -3.96 0.14 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.862 -1.149 . . . . 0.0 109.992 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.464 ' H ' ' C ' ' B' ' 571' ' ' GLU . 20.6 t80 -126.6 55.6 1.52 Allowed 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.931 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.1 m -94.25 177.68 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-O 121.711 0.767 . . . . 0.0 110.818 -178.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.579 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.62 145.06 33.27 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.45 74.21 3.28 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 116.621 -2.031 . . . . 0.0 109.03 178.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.34 -47.45 0.09 Allowed 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 102.87 -3.011 . . . . 0.0 102.87 173.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.572 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.6 p -132.95 81.28 1.93 Allowed 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 112.282 -2.236 . . . . 0.0 104.975 177.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 1.074 HD13 ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.67 15.5 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -176.459 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.572 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.09 -36.95 17.83 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 119.474 -2.016 . . . . 0.0 112.69 -178.302 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -160.36 140.1 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 119.416 -2.052 . . . . 0.0 114.969 178.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.579 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.6 tp -139.53 169.3 18.0 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 175.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.455 ' O ' ' N ' ' B' ' 587' ' ' PHE . 71.8 m-20 -145.62 130.55 18.23 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.159 -0.963 . . . . 0.0 108.864 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -52.44 -21.38 3.62 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.433 -0.792 . . . . 0.0 109.577 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.2 -16.35 60.94 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.124 -1.59 . . . . 0.0 109.124 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.6 p -134.66 26.27 3.7 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.906 -0.761 . . . . 0.0 108.971 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.565 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -88.64 109.69 20.32 Favored 'General case' 0 N--CA 1.494 1.774 0 CA-C-O 122.443 1.116 . . . . 0.0 109.484 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.46 162.55 12.96 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.2 tt0 -153.83 156.89 38.48 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 122.558 1.17 . . . . 0.0 111.026 -178.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.498 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 4.4 tt0 -156.46 141.52 17.25 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 105.985 -1.857 . . . . 0.0 105.985 178.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.706 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.95 25.81 3.32 Favored 'General case' 0 C--N 1.295 -1.799 0 O-C-N 120.846 -1.159 . . . . 0.0 109.288 178.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.465 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.8 m-20 79.85 -7.7 1.64 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.708 -0.62 . . . . 0.0 111.365 178.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . 0.458 ' O ' ' CE2' ' B' ' 595' ' ' TYR . 15.9 mttt -86.99 115.69 63.47 Favored Pre-proline 0 C--N 1.295 -1.791 0 O-C-N 121.153 -0.967 . . . . 0.0 110.282 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.597 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 32.7 Cg_exo -53.31 160.53 4.7 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 CA-C-N 119.969 1.025 . . . . 0.0 111.979 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.597 ' CD1' ' O ' ' B' ' 594' ' ' PRO . 51.8 m-85 -168.19 135.59 2.15 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.623 -0.673 . . . . 0.0 110.167 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.7 m -65.53 154.97 37.12 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 105.103 -2.184 . . . . 0.0 105.103 175.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.58 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.73 -57.35 13.06 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 178.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.09 -29.18 1.41 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 17.8 m -81.81 -61.18 1.99 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.537 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -56.59 -52.26 65.51 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.207 0.527 . . . . 0.0 110.133 -179.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.687 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -50.95 -43.33 60.26 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.055 -1.028 . . . . 0.0 109.072 -178.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.562 ' O ' HG21 ' A' ' 75' ' ' THR . 0.6 OUTLIER -55.59 -21.2 16.34 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.558 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.426 HD13 ' CD1' ' A' ' 46' ' ' LEU . 1.7 mt -94.24 -56.41 2.85 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.86 -1.15 . . . . 0.0 111.111 -178.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.487 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 23.9 m-85 -94.91 5.5 51.73 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.934 -1.104 . . . . 0.0 110.11 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.487 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 20.0 m . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.958 -1.089 . . . . 0.0 109.41 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.8 ttt . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.53 ' O ' ' N ' ' A' ' 4' ' ' ASP . . . -160.72 -48.35 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.886 -1.134 . . . . 0.0 109.318 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.479 ' C ' ' O ' ' A' ' 2' ' ' ALA . 20.1 mt 23.6 -85.74 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 121.728 0.775 . . . . 0.0 112.056 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.53 ' N ' ' O ' ' A' ' 2' ' ' ALA . 11.8 t0 51.56 18.56 0.71 Allowed 'General case' 0 C--N 1.3 -1.553 0 CA-C-O 122.253 1.025 . . . . 0.0 108.314 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.444 ' N ' ' C ' ' A' ' 3' ' ' LEU . . . -69.87 -7.98 60.05 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 108.375 -1.89 . . . . 0.0 108.375 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.523 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -112.92 -111.45 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -178.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.473 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -159.22 -94.14 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 O-C-N 120.335 -1.478 . . . . 0.0 110.398 -179.848 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.578 ' O ' ' N ' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -131.35 -54.86 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.547 0 O-C-N 121.022 -1.049 . . . . 0.0 111.786 -178.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -48.95 -19.62 2.42 Favored 'Trans proline' 0 N--CA 1.489 1.238 0 CA-C-N 120.916 1.363 . . . . 0.0 109.486 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.435 ' N ' ' C ' ' A' ' 8' ' ' MET . 10.1 t70 -142.21 -18.14 0.72 Allowed 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.882 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.99 -14.32 49.55 Favored Glycine 0 N--CA 1.493 2.45 0 O-C-N 121.025 -1.047 . . . . 0.0 111.299 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.539 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 2.8 t -173.94 -34.08 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.612 -1.522 . . . . 0.0 111.266 -179.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.671 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 4.7 t80 86.38 -43.53 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 160.45 -47.96 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -153.38 7.1 0.37 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.96 14.09 75.97 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 108.258 -1.937 . . . . 0.0 108.258 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 32.9 p -91.09 122.84 34.07 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.714 -0.874 . . . . 0.0 109.987 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -129.66 121.49 27.09 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.613 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.84 128.93 35.51 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.247 -0.908 . . . . 0.0 108.875 -179.664 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.546 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -83.67 132.3 34.89 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.411 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.56 145.71 34.67 Favored 'General case' 0 C--N 1.296 -1.728 0 C-N-CA 119.726 -0.79 . . . . 0.0 110.22 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.9 t -135.4 103.97 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 CA-C-O 121.586 0.707 . . . . 0.0 109.49 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -78.05 104.48 8.64 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 178.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.547 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.4 t -69.83 108.77 2.21 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.003 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.8 p -77.42 162.86 26.89 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.4 t0 73.16 -43.74 0.57 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.49 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.4 mt -92.73 -36.67 12.79 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 78.53 18.17 1.02 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.868 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -93.04 -178.94 4.95 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.834 -1.166 . . . . 0.0 109.436 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -137.93 113.87 9.9 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 16.2 t -110.58 152.37 12.58 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 CA-C-O 121.59 0.71 . . . . 0.0 109.45 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.448 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.82 130.52 38.05 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.448 HD22 ' C ' ' A' ' 32' ' ' THR . 2.9 mm? -114.22 112.98 24.01 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.687 -0.633 . . . . 0.0 109.39 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -59.79 105.63 0.4 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 m -135.37 -170.39 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 CA-C-O 121.812 0.815 . . . . 0.0 110.13 -178.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.8 p -142.12 175.03 10.06 Favored 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.61 47.87 3.1 Favored Glycine 0 N--CA 1.483 1.799 0 N-CA-C 109.068 -1.613 . . . . 0.0 109.068 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.437 ' C ' HG21 ' A' ' 78' ' ' THR . 0.0 OUTLIER -147.38 -3.57 0.55 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.482 -1.01 . . . . 0.0 108.998 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.3 m -86.55 128.28 39.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.062 -1.024 . . . . 0.0 110.081 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 43' ' ' GLY . 5.6 m-70 -63.36 149.76 45.04 Favored 'General case' 0 C--N 1.29 -1.992 0 C-N-CA 118.818 -1.153 . . . . 0.0 107.985 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.446 ' C ' ' N ' ' A' ' 43' ' ' GLY . 25.4 mt -49.64 -54.69 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 120.972 -1.08 . . . . 0.0 108.523 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.653 ' H ' HG23 ' A' ' 75' ' ' THR . . . -56.06 -12.2 5.34 Favored Glycine 0 C--N 1.299 -1.526 0 N-CA-C 108.139 -1.984 . . . . 0.0 108.139 179.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -65.69 -27.46 72.68 Favored Glycine 0 N--CA 1.482 1.703 0 N-CA-C 107.357 -2.297 . . . . 0.0 107.357 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.3 t -83.68 -44.81 18.48 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 34.1 mtm -46.96 -37.16 8.61 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -67.48 -65.67 0.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.347 0.594 . . . . 0.0 110.57 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.0 mttt -53.36 -53.38 51.9 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.391 -0.818 . . . . 0.0 111.009 -178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -45.54 -59.24 2.83 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.723 -1.236 . . . . 0.0 109.687 -179.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.726 HG22 ' CD2' ' A' ' 58' ' ' TRP . 85.1 t -54.25 -51.45 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 120.849 -1.157 . . . . 0.0 109.749 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -44.79 -40.22 5.92 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.355 -0.841 . . . . 0.0 110.145 -179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -68.21 -57.57 5.81 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.157 -0.964 . . . . 0.0 111.275 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.406 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.9 OUTLIER -62.11 -66.33 0.56 Allowed 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.82 -1.175 . . . . 0.0 109.014 -179.162 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.0 t70 72.38 82.54 0.14 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.928 0.871 . . . . 0.0 109.914 179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.522 ' C ' ' H ' ' A' ' 56' ' ' LYS . 1.7 p -167.05 150.22 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.146 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.815 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -68.36 35.02 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.499 -0.75 . . . . 0.0 110.139 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.522 ' H ' ' C ' ' A' ' 54' ' ' VAL . 3.2 ttpm? -81.78 155.56 25.38 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.082 -1.011 . . . . 0.0 109.512 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -49.66 112.43 0.65 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.274 -0.891 . . . . 0.0 109.649 -179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.726 ' CD2' HG22 ' A' ' 49' ' ' VAL . 30.1 m95 -125.09 -30.31 3.22 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.562 -0.711 . . . . 0.0 110.045 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -56.6 13.72 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 120.914 -1.116 . . . . 0.0 110.797 -178.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.43 ' O ' ' O ' ' A' ' 94' ' ' PRO . 15.1 t0 -69.4 -4.0 16.62 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.106 -0.997 . . . . 0.0 110.396 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -72.99 153.62 40.85 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 122.133 0.968 . . . . 0.0 110.676 -179.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -167.87 155.52 8.57 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.832 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.6 mm? -93.73 148.42 22.13 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 120.893 -1.13 . . . . 0.0 109.708 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.543 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.48 148.68 50.31 Favored 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.023 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.548 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -107.96 91.45 3.65 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.073 -1.017 . . . . 0.0 108.43 -178.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -55.23 -22.53 18.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.122 -0.986 . . . . 0.0 111.203 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.482 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -65.18 -18.61 65.45 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 105.515 -2.032 . . . . 0.0 105.515 178.177 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.3 mmtt -123.95 -13.07 7.43 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.428 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.548 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.4 mpp_? 53.54 46.29 26.41 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 -177.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.9 t -113.49 -172.5 2.08 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.473 0.654 . . . . 0.0 109.851 -178.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.475 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.64 104.38 8.35 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 177.672 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.446 ' HB3' HD13 ' A' ' 41' ' ' ILE . 46.2 mt -62.86 83.95 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.256 0 O-C-N 120.474 -1.391 . . . . 0.0 110.995 -176.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.475 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -119.02 6.73 11.32 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.482 ' O ' ' N ' ' A' ' 76' ' ' HIS . 5.9 mmpt? -76.36 32.76 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.653 HG23 ' H ' ' A' ' 42' ' ' GLY . 7.2 m -50.52 -10.08 0.06 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.102 -0.999 . . . . 0.0 109.661 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.487 ' CD2' ' CE3' ' A' ' 77' ' ' TRP . 5.0 t60 -53.47 -65.93 0.48 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.233 -0.917 . . . . 0.0 109.265 179.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.487 ' CE3' ' CD2' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -85.73 -143.16 0.1 Allowed 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 179.572 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.638 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -130.47 169.67 15.22 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.661 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -60.19 -50.34 74.04 Favored 'General case' 0 C--N 1.287 -2.142 0 O-C-N 121.327 -0.858 . . . . 0.0 109.952 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.453 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 19.9 t70 -43.89 -35.89 2.17 Favored 'General case' 0 C--N 1.298 -1.647 0 CA-C-O 122.19 0.995 . . . . 0.0 109.124 177.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.638 ' CG ' ' H ' ' A' ' 78' ' ' THR . 44.5 mmtt -65.12 -51.35 61.76 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -44.89 95.71 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 178.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 115.14 37.29 1.13 Allowed Glycine 0 N--CA 1.511 3.695 0 N-CA-C 109.299 -1.521 . . . . 0.0 109.299 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.543 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 56.8 mt -92.96 161.98 2.46 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.543 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -165.01 -166.03 0.97 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.259 -0.9 . . . . 0.0 109.465 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.92 -22.08 64.18 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.461 -0.774 . . . . 0.0 109.784 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.71 -5.48 58.15 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.31 -0.869 . . . . 0.0 108.779 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.33 112.44 24.62 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.537 -0.727 . . . . 0.0 109.196 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.4 mmtp -97.2 115.4 27.52 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.996 -1.065 . . . . 0.0 109.61 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.546 ' HG ' HD12 ' A' ' 20' ' ' LEU . 7.1 mt -93.42 176.18 6.48 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.543 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.0 mt-30 -135.19 157.15 47.66 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.476 ' CD2' ' C ' ' A' ' 92' ' ' PHE . 0.6 OUTLIER -105.76 131.86 52.6 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.365 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.8 151.86 50.69 Favored Pre-proline 0 N--CA 1.5 2.052 0 O-C-N 120.95 -1.094 . . . . 0.0 109.196 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' A' ' 60' ' ' ASP . 74.3 Cg_endo . . . . . 0 N--CA 1.495 1.603 0 C-N-CA 122.375 2.05 . . . . 0.0 111.65 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -68.94 -101.81 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.232 -0.917 . . . . 0.0 109.488 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.484 ' O ' ' N ' ' B' ' 545' ' ' ARG . 2.1 pp20? -140.57 -0.44 1.56 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.284 -0.885 . . . . 0.0 109.637 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.467 ' CG ' HH21 ' B' ' 544' ' ' ARG . 0.0 OUTLIER -66.34 68.44 0.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.196 -0.94 . . . . 0.0 109.457 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.517 ' HG2' HH21 ' B' ' 545' ' ' ARG . 0.3 OUTLIER -83.08 -148.06 0.09 Allowed 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.264 -0.898 . . . . 0.0 109.382 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -159.95 -98.76 0.14 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.6 m -171.89 120.42 0.45 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.333 -1.098 . . . . 0.0 108.113 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.68 134.68 57.32 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 120.808 -1.183 . . . . 0.0 110.216 -178.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.498 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.37 104.03 13.21 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 178.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.6 t -50.88 127.03 17.55 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 122.174 0.988 . . . . 0.0 109.668 -177.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.59 -34.65 5.35 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 106.081 -2.807 . . . . 0.0 106.081 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -105.58 -35.94 7.27 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.455 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.2 mm-40 55.07 56.39 6.61 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 122.73 1.252 . . . . 0.0 109.914 -178.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -140.57 123.7 10.09 Favored Pre-proline 0 C--N 1.295 -1.798 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -44.31 134.83 9.0 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 CA-C-N 120.446 1.195 . . . . 0.0 114.633 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.1 mt -93.9 98.41 8.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . 0.409 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.6 p -99.54 91.26 4.82 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.258 -0.901 . . . . 0.0 111.208 -178.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.46 -96.12 0.15 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 107.396 -2.282 . . . . 0.0 107.396 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.472 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.15 151.15 31.23 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 177.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.5 p -144.55 126.28 15.2 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.462 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 48.0 mt -90.85 146.62 5.98 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.579 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 8.3 m -117.93 146.77 43.73 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 121.743 0.782 . . . . 0.0 109.041 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.51 -129.36 0.26 Allowed 'General case' 0 C--N 1.294 -1.814 0 CA-C-O 121.598 0.713 . . . . 0.0 109.228 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 4.0 mtt -65.84 26.27 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.33 -9.11 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 14.1 mtmt -81.75 162.58 22.89 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -104.63 174.97 5.65 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.213 -1.402 . . . . 0.0 107.213 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -160.99 133.7 6.22 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 117.986 -1.486 . . . . 0.0 110.257 -178.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.594 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.7 m80 -54.32 115.17 7.88 Favored Pre-proline 0 C--N 1.304 -1.393 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 177.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.532 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.1 Cg_exo -45.38 -8.32 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 CA-C-N 120.278 1.135 . . . . 0.0 112.412 -178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.729 ' O ' HG13 ' B' ' 574' ' ' VAL . 8.5 mt-10 -104.11 -53.12 2.8 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 122.154 0.978 . . . . 0.0 109.757 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.449 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.6 m170 -54.73 -5.55 0.09 Allowed 'General case' 0 C--N 1.293 -1.86 0 O-C-N 120.431 -1.418 . . . . 0.0 109.734 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.491 ' H ' ' C ' ' B' ' 571' ' ' GLU . 15.9 t80 -125.45 53.46 1.54 Allowed 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.729 HG13 ' O ' ' B' ' 571' ' ' GLU . 12.5 m -93.5 176.75 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.622 -0.674 . . . . 0.0 109.94 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.591 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.12 142.03 36.77 Favored 'General case' 0 N--CA 1.503 2.186 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.14 74.83 4.04 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 116.58 -2.048 . . . . 0.0 109.774 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.96 -57.87 0.15 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 101.655 -3.461 . . . . 0.0 101.655 172.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.552 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.1 p -122.39 78.48 1.51 Allowed 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 111.922 -2.399 . . . . 0.0 104.738 176.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 0.631 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.8 mp -52.01 16.3 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -176.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.552 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -84.37 -37.42 21.56 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 119.476 -2.015 . . . . 0.0 112.328 -178.406 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.532 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -161.32 143.39 11.97 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 119.474 -2.016 . . . . 0.0 114.199 178.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.591 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.7 tp -138.95 170.69 15.53 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.452 ' O ' ' N ' ' B' ' 587' ' ' PHE . 69.0 m-20 -146.56 137.87 24.37 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.263 -0.898 . . . . 0.0 109.394 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.579 ' CE ' ' H ' ' B' ' 562' ' ' THR . 6.1 ptpp? -55.29 -22.43 18.67 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.582 0.706 . . . . 0.0 110.09 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.05 -17.06 59.96 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 109.109 -1.596 . . . . 0.0 109.109 -179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.9 p -131.18 23.56 4.86 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.967 -0.725 . . . . 0.0 109.344 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.538 ' O ' ' CG ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.7 113.02 25.0 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-O 122.235 1.017 . . . . 0.0 109.341 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -107.25 165.0 11.7 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 179.022 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.45 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.4 tt0 -152.13 156.99 40.93 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 122.719 1.247 . . . . 0.0 110.47 -178.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.642 ' NE2' ' CE2' ' B' ' 600' ' ' PHE . 0.0 OUTLIER -160.96 146.55 14.44 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.589 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.37 22.82 0.5 Allowed 'General case' 0 C--N 1.296 -1.742 0 O-C-N 120.749 -1.219 . . . . 0.0 109.425 -178.718 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.0 m-20 79.91 -6.38 1.77 Allowed 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.636 -0.665 . . . . 0.0 111.448 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . 0.52 ' O ' ' CE1' ' B' ' 595' ' ' TYR . 33.3 mttm -88.96 115.89 64.8 Favored Pre-proline 0 C--N 1.294 -1.832 0 O-C-N 121.064 -1.022 . . . . 0.0 110.121 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.562 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 33.0 Cg_exo -51.54 163.14 1.23 Allowed 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 119.998 1.035 . . . . 0.0 112.369 179.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.562 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 66.4 m-85 -169.78 142.31 2.44 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.449 -0.782 . . . . 0.0 110.099 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 5.9 m -67.42 154.86 40.38 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.543 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.07 -58.01 10.54 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -48.29 -24.96 1.35 Allowed 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.629 -0.669 . . . . 0.0 110.025 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . 0.413 ' O ' ' HG ' ' B' ' 603' ' ' LEU . 1.4 m -77.08 -65.69 0.92 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.23 -0.919 . . . . 0.0 110.432 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.642 ' CE2' ' NE2' ' B' ' 590' ' ' GLN . 2.1 t80 -70.81 -40.49 72.45 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.848 -1.157 . . . . 0.0 111.261 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.687 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -52.11 -42.94 63.68 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.455 ' O ' HG21 ' A' ' 75' ' ' THR . 18.9 tptm -54.84 -25.33 27.83 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' B' ' 600' ' ' PHE . 11.6 mt -95.29 -57.95 2.27 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.477 -0.764 . . . . 0.0 111.652 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.494 ' CD1' ' CE2' ' B' ' 600' ' ' PHE . 13.0 m-85 -100.81 32.62 3.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.97 -1.082 . . . . 0.0 110.268 -179.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 N--CA 1.5 2.048 0 O-C-N 121.087 -1.008 . . . . 0.0 109.698 179.526 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ttm . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.433 ' O ' ' O ' ' A' ' 7' ' ' ARG . . . -147.79 -55.81 0.23 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.992 -1.067 . . . . 0.0 108.803 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.586 ' C ' ' H ' ' A' ' 5' ' ' GLY . 57.7 mt -43.92 -80.0 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.916 0.865 . . . . 0.0 109.694 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.535 ' OD1' HD11 ' A' ' 6' ' ' ILE . 9.1 t0 61.43 -6.88 0.11 Allowed 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.725 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.586 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 115.84 -12.0 17.89 Favored Glycine 0 N--CA 1.493 2.45 0 N-CA-C 108.359 -1.896 . . . . 0.0 108.359 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.623 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -116.71 -106.4 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -178.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.5 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -153.95 -97.83 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 120.623 -1.298 . . . . 0.0 109.922 -179.203 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.565 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -140.58 -61.2 0.02 OUTLIER Pre-proline 0 N--CA 1.503 2.191 0 O-C-N 120.993 -1.067 . . . . 0.0 110.162 -179.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.441 ' O ' ' O ' ' A' ' 13' ' ' TYR . 65.4 Cg_exo -44.9 -35.18 9.62 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 CA-C-N 121.119 1.436 . . . . 0.0 109.911 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -111.67 -25.15 9.67 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.03 9.41 74.75 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.565 ' N ' ' O ' ' A' ' 8' ' ' MET . 51.8 t -156.62 -70.61 0.1 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.266 -1.138 . . . . 0.0 110.631 -179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.457 ' CG ' ' O ' ' A' ' 12' ' ' CYS . 24.5 m-85 -162.31 -86.39 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.991 -1.068 . . . . 0.0 109.591 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -174.08 -36.49 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -152.17 8.14 0.47 Allowed 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.88 11.34 85.31 Favored Glycine 0 N--CA 1.488 2.123 0 N-CA-C 108.506 -1.838 . . . . 0.0 108.506 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 17' ' ' THR . 4.8 t -103.57 122.43 44.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.752 -0.852 . . . . 0.0 109.736 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.512 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -119.2 128.19 53.99 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -80.11 136.19 36.48 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.375 -0.828 . . . . 0.0 110.074 -179.392 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.492 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.45 132.78 34.16 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 107.319 -1.364 . . . . 0.0 107.319 178.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.96 145.49 36.03 Favored 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.788 -1.195 . . . . 0.0 108.234 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.9 t -140.46 115.96 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 CA-C-O 121.719 0.771 . . . . 0.0 110.303 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 21.8 m-70 -88.6 103.69 16.15 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.574 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.0 OUTLIER -68.96 108.31 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.527 ' C ' ' H ' ' A' ' 27' ' ' LEU . 2.3 p -75.62 -55.94 5.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.274 -0.891 . . . . 0.0 110.566 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.546 ' CB ' ' NE2' ' A' ' 61' ' ' HIS . 25.6 t0 -58.24 1.06 0.06 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.039 -1.038 . . . . 0.0 109.824 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.527 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.6 mt -134.51 -25.09 1.52 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.341 -0.849 . . . . 0.0 109.433 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.574 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 76.14 14.26 2.53 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.923 -0.486 . . . . 0.0 110.199 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -94.04 -178.07 4.52 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.871 -1.143 . . . . 0.0 109.836 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -136.76 119.12 15.71 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.775 -1.195 . . . . 0.0 107.775 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.448 HG12 ' N ' ' A' ' 32' ' ' THR . 23.1 t -122.54 157.8 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 CA-C-O 121.658 0.742 . . . . 0.0 110.065 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.493 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.07 133.42 42.97 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -179.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.493 HD22 ' C ' ' A' ' 32' ' ' THR . 3.9 mm? -115.27 113.12 23.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.618 -0.676 . . . . 0.0 110.151 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.445 ' CA ' ' HE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -58.52 114.05 2.29 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 179.001 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.4 m -140.88 -170.2 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-O 121.967 0.889 . . . . 0.0 110.498 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.5 p -144.18 175.3 10.17 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.92 43.79 3.03 Favored Glycine 0 N--CA 1.482 1.733 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.477 ' C ' HG21 ' A' ' 78' ' ' THR . 7.3 pt-20 -145.25 5.14 1.09 Allowed 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.573 ' O ' HG22 ' A' ' 78' ' ' THR . 2.6 m -89.97 136.81 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.015 -1.053 . . . . 0.0 109.993 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.499 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m-70 -75.31 141.87 43.33 Favored 'General case' 0 C--N 1.292 -1.924 0 O-C-N 120.96 -1.088 . . . . 0.0 108.232 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.451 ' C ' ' N ' ' A' ' 43' ' ' GLY . 32.3 mt -47.07 -57.99 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.001 -1.062 . . . . 0.0 109.654 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.554 ' H ' HG23 ' A' ' 75' ' ' THR . . . -54.05 -13.49 3.56 Favored Glycine 0 N--CA 1.486 1.997 0 N-CA-C 108.143 -1.983 . . . . 0.0 108.143 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -73.6 -28.89 64.52 Favored Glycine 0 N--CA 1.485 1.944 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.8 t -83.74 -39.01 14.62 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 107.867 -1.161 . . . . 0.0 107.867 179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.458 ' O ' HG23 ' A' ' 49' ' ' VAL . 27.7 mtm -46.47 -39.88 11.43 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.623 HD12 HD13 ' B' ' 603' ' ' LEU . 0.4 OUTLIER -78.33 -58.1 3.43 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.52 -0.737 . . . . 0.0 110.535 -178.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.41 ' CB ' HD12 ' A' ' 33' ' ' LEU . 39.0 mttm -47.89 -59.34 3.41 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.775 -1.203 . . . . 0.0 109.893 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 36.0 tp -45.75 -38.28 6.85 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.337 -0.852 . . . . 0.0 109.391 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 45' ' ' MET . 81.4 t -78.37 -42.39 26.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.155 -0.966 . . . . 0.0 109.403 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.429 ' O ' ' OD1' ' A' ' 53' ' ' ASP . 39.5 mm-40 -46.54 -39.92 11.77 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.272 -0.892 . . . . 0.0 109.276 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.485 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.0 mtmp? -74.78 -34.01 62.37 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 121.536 -0.727 . . . . 0.0 109.278 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.52 -69.02 0.51 Allowed 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 50' ' ' GLU . 91.2 m-20 52.8 68.09 0.89 Allowed 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.17 0.509 . . . . 0.0 109.725 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.618 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.7 OUTLIER -136.42 32.06 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-O 122.0 0.905 . . . . 0.0 109.927 -178.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.42 ' HG3' HD12 ' B' ' 579' ' ' LEU . 24.1 tptt 41.66 19.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.732 -0.605 . . . . 0.0 110.647 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.537 ' N ' ' O ' ' A' ' 54' ' ' VAL . 28.3 ttmt -75.65 151.37 37.76 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.826 -1.171 . . . . 0.0 107.939 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.46 ' OD1' ' N ' ' A' ' 57' ' ' ASP . 0.7 OUTLIER -53.59 89.78 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.405 -0.809 . . . . 0.0 108.925 -179.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.528 ' N ' ' O ' ' A' ' 56' ' ' LYS . 10.7 m0 -78.3 -43.47 27.9 Favored 'General case' 0 C--N 1.3 -1.55 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.514 ' C ' ' H ' ' A' ' 61' ' ' HIS . 32.2 t -54.2 -48.69 70.72 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.609 -0.682 . . . . 0.0 109.249 179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -59.59 -1.41 0.24 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.387 -0.82 . . . . 0.0 109.16 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.546 ' NE2' ' CB ' ' A' ' 26' ' ' ASP . 14.9 m80 -123.18 147.93 46.33 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.619 -0.676 . . . . 0.0 109.477 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.532 ' H ' ' C ' ' A' ' 93' ' ' THR . . . -156.38 179.35 9.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.384 -0.822 . . . . 0.0 108.828 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.721 HD22 ' N ' ' A' ' 63' ' ' LEU . 2.9 mm? -94.92 140.43 29.95 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.02 -1.05 . . . . 0.0 110.502 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.516 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -134.67 146.6 49.65 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.5 t90 -105.82 91.34 3.7 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.938 -1.101 . . . . 0.0 108.751 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE1' ' OE1' ' A' ' 91' ' ' GLN . 9.7 pt-20 -55.92 -22.52 26.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.968 . . . . 0.0 110.811 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -64.9 -18.09 64.9 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 178.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -125.45 -11.37 6.84 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 115.045 -0.979 . . . . 0.0 109.303 -178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.2 mpp_? 53.34 47.38 24.34 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 -178.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -115.14 -170.75 1.82 Allowed 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.45 0.643 . . . . 0.0 110.033 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.549 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -124.28 99.83 6.41 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.902 -1.888 . . . . 0.0 105.902 177.081 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.0 86.5 0.01 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.676 -1.265 . . . . 0.0 110.895 -176.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.1 pp -121.35 4.33 10.26 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.514 ' C ' ' H ' ' A' ' 76' ' ' HIS . 0.2 OUTLIER -69.82 35.09 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.062 -1.024 . . . . 0.0 109.306 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.554 HG23 ' H ' ' A' ' 42' ' ' GLY . 21.8 m -51.73 -7.18 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.684 -1.26 . . . . 0.0 109.849 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.514 ' H ' ' C ' ' A' ' 74' ' ' LYS . 1.1 t60 -50.31 -73.14 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.183 -0.948 . . . . 0.0 110.2 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -90.64 -112.43 0.08 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.083 -1.011 . . . . 0.0 109.961 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.573 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -152.83 -163.39 1.7 Allowed 'General case' 0 N--CA 1.504 2.233 0 O-C-N 119.563 -1.961 . . . . 0.0 111.445 -178.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.597 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.8 mp -70.51 -57.27 4.94 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -42.68 -45.68 4.79 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 114.843 -1.071 . . . . 0.0 111.127 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -60.83 -31.11 70.54 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -178.58 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.511 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -83.18 -47.94 11.04 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.38 7.17 12.56 Favored Glycine 0 N--CA 1.501 3.012 0 N-CA-C 108.547 -1.821 . . . . 0.0 108.547 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.515 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 36.9 mt -61.15 160.49 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.515 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -154.15 -164.42 1.85 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.146 -0.971 . . . . 0.0 108.986 179.702 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -75.25 -17.28 60.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.348 -0.845 . . . . 0.0 109.772 179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.06 3.85 50.33 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.492 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.02 113.34 25.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.284 -0.885 . . . . 0.0 108.981 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -96.03 123.63 39.72 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.001 -1.062 . . . . 0.0 109.994 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.474 ' HG ' HD12 ' A' ' 20' ' ' LEU . 3.6 mt -106.46 177.94 4.71 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.771 0.795 . . . . 0.0 109.123 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.516 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 6.0 mt-30 -131.87 165.36 24.04 Favored 'General case' 0 C--N 1.298 -1.668 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -117.05 91.34 3.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.532 ' C ' ' H ' ' A' ' 62' ' ' ALA . 0.3 OUTLIER -146.21 161.74 37.88 Favored Pre-proline 0 N--CA 1.497 1.919 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -178.527 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.49 1.275 0 C-N-CA 122.385 2.056 . . . . 0.0 111.761 179.712 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 79.4 t80 . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 22.6 m80 -60.52 -171.98 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.325 -0.859 . . . . 0.0 109.796 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -107.59 -33.62 7.26 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.568 ' HD3' ' H ' ' B' ' 544' ' ' ARG . 0.0 OUTLIER -81.34 92.11 6.35 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.238 -0.914 . . . . 0.0 109.706 -179.824 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.462 ' CG ' HH21 ' B' ' 545' ' ' ARG . 0.0 OUTLIER -72.11 -158.19 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.387 0 O-C-N 121.215 -0.928 . . . . 0.0 109.421 179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -147.55 -99.15 0.22 Allowed Glycine 0 N--CA 1.495 2.581 0 N-CA-C 109.217 -1.553 . . . . 0.0 109.217 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.539 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.5 m -159.5 116.64 2.65 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 4.9 mp -61.67 135.58 57.68 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 120.949 -1.094 . . . . 0.0 110.259 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.517 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.38 103.5 12.79 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 178.41 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.3 t -50.22 126.1 13.99 Favored 'General case' 0 C--N 1.3 -1.556 0 CA-C-O 122.153 0.978 . . . . 0.0 109.628 -177.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.17 5.6 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 106.304 -2.718 . . . . 0.0 106.304 -177.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 5.1 m -105.94 -35.82 7.17 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.462 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.0 mm-40 55.16 56.22 6.74 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 122.658 1.218 . . . . 0.0 110.004 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp -140.79 124.21 10.13 Favored Pre-proline 0 C--N 1.293 -1.853 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -44.38 136.05 8.69 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.447 1.195 . . . . 0.0 114.612 -178.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.539 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.0 mt -95.37 98.26 7.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.6 p -100.11 90.72 4.47 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.259 -0.901 . . . . 0.0 111.169 -177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 157.01 -95.87 0.15 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.405 -2.278 . . . . 0.0 107.405 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.458 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.5 mmt180 -113.15 149.52 33.48 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 177.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.34 126.36 15.47 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.984 -1.073 . . . . 0.0 111.455 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . 0.519 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 48.9 mt -91.14 146.86 5.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 178.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.691 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.9 m -117.28 146.96 42.98 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 121.766 0.793 . . . . 0.0 109.131 179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.67 -129.3 0.26 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-O 121.551 0.691 . . . . 0.0 109.401 -178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.55 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.2 mtt -65.78 26.26 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.2 -8.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 -178.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -81.42 164.45 22.06 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -106.94 174.5 5.86 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.07 -1.456 . . . . 0.0 107.07 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.88 137.57 8.72 Favored 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 118.104 -1.438 . . . . 0.0 110.005 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.603 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.3 m80 -57.11 116.01 12.23 Favored Pre-proline 0 C--N 1.3 -1.574 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 177.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.55 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 50.9 Cg_exo -43.9 -9.38 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.391 0 CA-C-N 120.129 1.082 . . . . 0.0 112.755 -178.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.915 ' O ' HG13 ' B' ' 574' ' ' VAL . 6.9 mt-10 -105.26 -52.85 2.76 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.197 -0.939 . . . . 0.0 110.037 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.449 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 13.3 m170 -55.79 -4.97 0.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.822 -1.174 . . . . 0.0 109.75 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.469 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.2 t80 -122.26 52.15 1.32 Allowed 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.915 HG13 ' O ' ' B' ' 571' ' ' GLU . 18.7 m -92.53 177.58 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.396 0 CA-C-O 121.58 0.705 . . . . 0.0 109.218 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.667 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -79.74 145.83 32.68 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.476 -0.765 . . . . 0.0 109.088 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . 0.464 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -93.55 77.16 4.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 117.019 -1.873 . . . . 0.0 108.809 178.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . 0.424 ' HE2' ' HG ' ' A' ' 59' ' ' SER . 85.4 t80 -151.28 -45.96 0.11 Allowed 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 101.802 -3.407 . . . . 0.0 101.802 174.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' B' ' 575' ' ' CYS . 0.8 OUTLIER -126.83 154.98 43.61 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 111.677 -2.511 . . . . 0.0 105.314 177.559 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 1.108 ' H ' HD22 ' B' ' 579' ' ' LEU . 0.0 OUTLIER -104.74 14.32 29.89 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.659 -1.276 . . . . 0.0 111.281 -178.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.557 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -100.28 -39.25 8.12 Favored 'General case' 0 N--CA 1.512 2.627 0 CA-C-N 120.909 1.686 . . . . 0.0 115.502 -176.181 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.57 142.44 9.48 Favored 'General case' 0 N--CA 1.503 2.209 0 CA-C-N 122.29 2.314 . . . . 0.0 115.846 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.667 HD13 ' HB2' ' B' ' 575' ' ' CYS . 24.2 tp -136.91 169.75 17.24 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 174.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.446 ' O ' ' N ' ' B' ' 587' ' ' PHE . 73.0 m-20 -147.32 129.66 15.73 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.992 -1.067 . . . . 0.0 109.299 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.691 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.0 ptpp? -51.17 -17.72 0.73 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.539 -0.726 . . . . 0.0 109.753 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -87.29 -20.81 51.28 Favored Glycine 0 N--CA 1.487 2.072 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.3 p -133.88 28.11 3.89 Favored 'General case' 0 C--N 1.299 -1.611 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.582 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.6 OUTLIER -89.64 106.98 18.82 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.736 1.255 . . . . 0.0 109.836 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.72 167.71 10.61 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 179.486 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -152.08 157.27 41.39 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 122.634 1.207 . . . . 0.0 110.721 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.546 ' NE2' ' CG ' ' B' ' 604' ' ' PHE . 2.1 tp60 -154.87 146.12 22.88 Favored 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 178.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.497 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.24 23.89 0.13 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.969 -1.082 . . . . 0.0 110.111 -179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.483 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.5 m-20 81.66 -4.9 1.57 Allowed 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.598 -0.689 . . . . 0.0 110.809 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 33.8 mttm -89.15 121.69 69.33 Favored Pre-proline 0 C--N 1.294 -1.827 0 O-C-N 121.296 -0.878 . . . . 0.0 109.457 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.48 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 44.7 Cg_exo -48.71 164.82 0.2 Allowed 'Trans proline' 0 N--CA 1.489 1.227 0 CA-C-N 119.945 1.016 . . . . 0.0 111.809 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.2 m-85 -170.51 141.48 1.93 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.626 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 20.6 m -76.16 155.74 34.32 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 104.455 -2.424 . . . . 0.0 104.455 174.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.585 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.77 -57.82 11.08 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 117.293 -1.763 . . . . 0.0 106.383 179.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.03 -29.09 1.34 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.503 -0.748 . . . . 0.0 109.359 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.8 m -80.89 -64.82 1.11 Allowed 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -53.35 -53.37 52.08 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.672 -0.642 . . . . 0.0 109.988 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.69 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -48.52 -42.34 32.85 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.092 -1.005 . . . . 0.0 108.776 -179.167 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 26.3 tptt -61.36 -20.4 62.95 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.38 -0.825 . . . . 0.0 110.26 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.623 HD13 HD12 ' A' ' 46' ' ' LEU . 7.7 mt -91.68 -56.29 3.16 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 120.69 -1.257 . . . . 0.0 110.409 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.546 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 3.8 m-85 -93.16 9.3 36.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 120.991 -1.068 . . . . 0.0 109.618 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.485 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 12.0 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.302 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 43.4 ttm . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.67 -45.08 0.24 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.755 -1.215 . . . . 0.0 108.323 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.905 ' H ' HD12 ' A' ' 3' ' ' LEU . 5.3 mp -63.7 -68.19 0.37 Allowed 'General case' 0 C--N 1.297 -1.699 0 CA-C-O 122.125 0.964 . . . . 0.0 109.226 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.422 ' O ' ' OD2' ' A' ' 4' ' ' ASP . 50.9 t0 -75.96 17.13 0.35 Allowed 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.486 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -61.5 -13.65 38.61 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 107.755 -2.138 . . . . 0.0 107.755 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.717 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -111.28 -95.25 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.24 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.546 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -152.03 -98.5 0.05 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.108 -0.995 . . . . 0.0 109.697 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.546 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -145.92 -62.99 0.02 OUTLIER Pre-proline 0 N--CA 1.5 2.042 0 O-C-N 120.985 -1.072 . . . . 0.0 110.816 -179.215 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -44.66 -35.8 9.61 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 CA-C-N 121.224 1.473 . . . . 0.0 110.071 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -111.57 -26.05 9.24 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 114.933 -1.03 . . . . 0.0 108.487 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.77 7.76 81.16 Favored Glycine 0 N--CA 1.489 2.169 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.535 ' N ' ' O ' ' A' ' 8' ' ' MET . 18.5 t -165.85 -28.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.249 -1.147 . . . . 0.0 110.327 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.676 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 84.5 m-85 52.88 -105.01 0.22 Allowed 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.676 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 159.12 -40.4 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -164.98 10.32 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 119.765 -0.774 . . . . 0.0 109.942 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.529 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 75.9 45.56 16.21 Favored Glycine 0 N--CA 1.488 2.147 0 N-CA-C 107.558 -2.217 . . . . 0.0 107.558 -178.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.2 p -75.66 121.92 23.2 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 122.006 0.908 . . . . 0.0 110.726 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -141.35 124.07 16.05 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 178.676 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.628 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.87 130.97 40.98 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.59 -1.319 . . . . 0.0 109.872 -179.173 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.478 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -84.55 130.68 34.71 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 179.107 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.78 146.15 33.95 Favored 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.331 -0.855 . . . . 0.0 109.818 -179.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.515 HG21 ' CE2' ' A' ' 92' ' ' PHE . 25.1 t -132.4 156.82 42.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-O 122.388 1.09 . . . . 0.0 110.042 178.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.538 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 15.7 m80 -128.42 98.91 5.21 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 104.195 -2.521 . . . . 0.0 104.195 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.56 ' O ' ' N ' ' A' ' 28' ' ' ASN . 9.0 t -73.15 94.35 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 C-N-CA 119.026 -1.07 . . . . 0.0 109.149 -178.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.491 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -64.99 169.08 5.64 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.742 -1.206 . . . . 0.0 107.742 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.425 ' CB ' ' O ' ' A' ' 25' ' ' THR . 0.9 OUTLIER 73.01 -45.52 0.62 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.491 ' H ' ' C ' ' A' ' 25' ' ' THR . 9.1 tp -92.15 -32.62 15.05 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 106.575 -1.639 . . . . 0.0 106.575 177.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.56 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 73.05 9.91 5.32 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.447 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.433 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 60.0 mtp180 -87.03 -179.79 6.54 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 120.53 -1.356 . . . . 0.0 108.947 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.538 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 1.0 OUTLIER -143.04 123.05 13.57 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 178.875 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.6 t -127.69 158.64 39.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 CA-C-O 121.415 0.626 . . . . 0.0 110.771 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -123.34 139.95 53.52 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 32' ' ' THR . 2.2 mm? -119.73 113.33 20.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.536 -0.727 . . . . 0.0 109.89 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -60.41 104.35 0.32 Allowed 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 18.5 m -129.17 -169.03 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 122.01 0.909 . . . . 0.0 110.566 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.1 p -143.39 166.32 25.09 Favored 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.486 ' N ' ' HE1' ' A' ' 18' ' ' TRP . . . -76.84 48.08 2.61 Favored Glycine 0 N--CA 1.485 1.937 0 C-N-CA 119.133 -1.508 . . . . 0.0 109.572 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.435 ' C ' HG21 ' A' ' 78' ' ' THR . 1.1 pp20? -153.59 2.43 0.27 Allowed 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.641 -0.917 . . . . 0.0 109.172 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 m -81.33 139.62 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 120.892 -1.13 . . . . 0.0 109.187 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.45 ' O ' ' N ' ' A' ' 43' ' ' GLY . 1.7 m80 -79.09 140.74 37.78 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.462 HD13 ' HB3' ' A' ' 72' ' ' LEU . 74.3 mt -46.9 -57.31 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.156 -0.965 . . . . 0.0 109.476 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.77 -10.26 8.15 Favored Glycine 0 N--CA 1.482 1.737 0 N-CA-C 109.399 -1.481 . . . . 0.0 109.399 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -80.69 -24.26 58.68 Favored Glycine 0 N--CA 1.481 1.671 0 N-CA-C 106.51 -2.636 . . . . 0.0 106.51 179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.534 ' CG1' ' N ' ' A' ' 45' ' ' MET . 0.4 OUTLIER -73.48 -55.65 11.89 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 114.681 -0.759 . . . . 0.0 109.094 179.738 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.534 ' N ' ' CG1' ' A' ' 44' ' ' VAL . 39.7 mtm -46.22 -32.04 2.81 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.26 -0.9 . . . . 0.0 108.942 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.436 HD12 HD13 ' B' ' 603' ' ' LEU . 3.2 tt -71.65 -28.9 64.07 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.12 -179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 25.1 mttm -88.82 -59.26 2.28 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.125 -1.609 . . . . 0.0 111.748 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.61 HD13 ' CZ ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -45.69 -55.78 6.03 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.762 -1.211 . . . . 0.0 109.001 -178.588 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 72.7 t -51.81 -50.82 31.06 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 C-N-CA 119.931 -0.708 . . . . 0.0 109.875 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -47.68 -41.13 21.81 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.914 -1.116 . . . . 0.0 109.566 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -68.11 -38.45 82.28 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.289 -0.882 . . . . 0.0 109.861 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.422 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -66.51 -69.44 0.3 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.17 -0.956 . . . . 0.0 108.829 -179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.422 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 7.7 t70 75.07 83.29 0.1 Allowed 'General case' 0 N--CA 1.488 1.438 0 CA-C-O 121.977 0.894 . . . . 0.0 109.977 179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.519 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.0 p -168.77 150.89 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 C-N-CA 119.388 -0.925 . . . . 0.0 109.977 -179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.63 27.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.524 -0.735 . . . . 0.0 109.448 -179.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.519 ' H ' ' C ' ' A' ' 54' ' ' VAL . 9.0 ttpp -78.75 147.36 33.41 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.902 -1.124 . . . . 0.0 109.634 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -69.48 112.53 6.07 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.543 -0.723 . . . . 0.0 109.249 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.536 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 79.3 m95 -108.39 -42.78 4.49 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.462 -0.774 . . . . 0.0 110.607 -179.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.8 t -45.45 -55.09 6.51 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.213 -0.929 . . . . 0.0 109.643 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -51.03 -33.98 27.67 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.537 ' CG ' ' O ' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -71.41 115.46 10.61 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-O 121.943 0.878 . . . . 0.0 109.261 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -121.15 164.28 17.13 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.878 HD22 ' H ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -93.87 141.16 28.83 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.882 -1.136 . . . . 0.0 110.97 -177.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.511 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.34 140.99 51.57 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -101.85 91.84 4.55 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 17.0 pt-20 -55.56 -21.99 19.69 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.122 -0.986 . . . . 0.0 111.005 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.488 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.1 OUTLIER -65.62 -19.38 65.89 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 105.647 -1.982 . . . . 0.0 105.647 178.154 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt -123.22 -12.66 7.84 Favored 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.441 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 53.9 45.36 27.91 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -177.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.9 t -112.64 -173.93 2.35 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.492 0.663 . . . . 0.0 110.032 -178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -127.39 99.33 5.59 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.462 ' HB3' HD13 ' A' ' 41' ' ' ILE . 15.8 mt -62.05 84.1 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.122 0 O-C-N 120.231 -1.543 . . . . 0.0 110.278 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.1 pp -113.6 14.02 18.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.565 ' NZ ' ' CZ ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -85.48 66.44 9.68 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.411 -0.806 . . . . 0.0 109.18 -179.807 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.61 HG21 ' O ' ' B' ' 602' ' ' LYS . 1.9 m -64.99 -6.7 9.16 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.24 -0.913 . . . . 0.0 109.776 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -84.43 -35.82 22.79 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.164 -0.96 . . . . 0.0 110.07 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.0 m95 -91.65 -160.25 0.71 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.115 -0.991 . . . . 0.0 109.505 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.658 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -150.01 169.18 21.81 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 122.086 0.946 . . . . 0.0 109.238 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.527 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 9.1 mp -43.65 -63.81 0.77 Allowed 'General case' 0 C--N 1.296 -1.743 0 CA-C-O 121.994 0.902 . . . . 0.0 109.257 179.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -43.01 -51.37 5.71 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.875 0.845 . . . . 0.0 110.075 -179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.658 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -45.44 -53.92 8.09 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-O 121.617 0.723 . . . . 0.0 109.794 -179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.565 ' CZ ' ' NZ ' ' A' ' 74' ' ' LYS . 10.5 m-85 -77.33 -40.21 44.98 Favored 'General case' 0 C--N 1.298 -1.653 0 C-N-CA 119.526 -0.869 . . . . 0.0 109.524 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.21 10.47 10.75 Favored Glycine 0 N--CA 1.5 2.952 0 N-CA-C 108.917 -1.673 . . . . 0.0 108.917 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.535 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.4 mt -61.09 160.19 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 O-C-N 121.537 -0.978 . . . . 0.0 108.937 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.535 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -171.83 -167.13 0.47 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.364 -0.835 . . . . 0.0 109.359 -179.38 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.63 -23.79 66.22 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.271 -0.893 . . . . 0.0 110.169 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -78.51 -8.03 58.12 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.237 -0.914 . . . . 0.0 108.673 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.69 26.23 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 22.5 mmtp -93.17 119.92 32.89 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.992 -1.067 . . . . 0.0 109.067 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.7 mt -99.32 176.03 5.67 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 121.795 0.807 . . . . 0.0 110.5 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.511 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.1 mt-30 -133.63 147.44 51.47 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.677 ' CD2' HD12 ' A' ' 63' ' ' LEU . 4.2 m-85 -113.27 97.64 6.61 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -161.16 152.49 15.84 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.298 -0.876 . . . . 0.0 111.28 -177.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo . . . . . 0 N--CA 1.493 1.47 0 C-N-CA 122.899 2.399 . . . . 0.0 112.447 178.444 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.363 0.602 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . 0.522 ' O ' ' N ' ' B' ' 544' ' ' ARG . 2.2 m80 -77.69 -54.89 5.83 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.306 -0.871 . . . . 0.0 109.407 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -43.27 -17.96 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.591 -0.693 . . . . 0.0 110.416 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' B' ' 542' ' ' HIS . 17.3 mmt180 -78.38 87.02 4.42 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.065 -1.022 . . . . 0.0 109.415 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.475 ' HD2' ' H ' ' B' ' 545' ' ' ARG . 0.0 OUTLIER -130.33 -41.87 1.22 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.377 -0.827 . . . . 0.0 109.759 -179.312 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . 0.45 ' O ' ' O ' ' B' ' 545' ' ' ARG . . . -50.93 -106.66 0.01 OUTLIER Glycine 0 N--CA 1.494 2.551 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.2 m -165.36 118.13 1.17 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.192 -1.181 . . . . 0.0 108.11 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.69 135.66 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 120.883 -1.135 . . . . 0.0 110.271 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.506 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.62 103.93 13.34 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 105.811 -1.922 . . . . 0.0 105.811 178.2 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.7 t -50.62 126.79 16.41 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-O 122.124 0.964 . . . . 0.0 109.727 -177.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.78 -34.92 5.17 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 106.208 -2.757 . . . . 0.0 106.208 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.0 m -105.34 -35.85 7.39 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.452 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.3 mm-40 55.68 56.4 6.2 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 122.656 1.217 . . . . 0.0 110.138 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -140.49 123.45 10.03 Favored Pre-proline 0 C--N 1.293 -1.865 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -44.29 134.99 8.9 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 120.534 1.227 . . . . 0.0 114.485 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.547 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.5 mt -93.92 98.2 7.91 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 24.7 p -100.07 91.13 4.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.228 -0.92 . . . . 0.0 111.333 -177.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.17 -97.07 0.16 Allowed Glycine 0 N--CA 1.486 2.028 0 N-CA-C 107.063 -2.415 . . . . 0.0 107.063 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.464 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 0.9 OUTLIER -111.94 150.64 30.23 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 106.985 -1.487 . . . . 0.0 106.985 177.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.32 125.78 14.89 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.227 1.013 . . . . 0.0 111.411 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . 0.608 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 47.0 mt -91.09 147.41 5.26 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.691 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 8.7 m -118.14 146.93 43.8 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-O 121.786 0.803 . . . . 0.0 109.072 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.725 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.22 -129.14 0.26 Allowed 'General case' 0 C--N 1.295 -1.768 0 CA-C-O 121.593 0.711 . . . . 0.0 109.359 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.6 mtt -65.65 26.28 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.725 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.21 -9.16 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -178.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt -82.28 162.17 22.38 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -103.9 174.31 5.93 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -159.75 138.55 10.75 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 118.211 -1.395 . . . . 0.0 109.861 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.605 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.6 m80 -57.89 116.99 16.22 Favored Pre-proline 0 C--N 1.299 -1.63 0 N-CA-C 105.394 -2.076 . . . . 0.0 105.394 177.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.545 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 53.1 Cg_exo -45.38 -9.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.403 0 CA-C-N 120.33 1.154 . . . . 0.0 111.793 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.921 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.9 mt-10 -100.02 -52.33 3.45 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-O 122.155 0.979 . . . . 0.0 109.977 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -58.21 -3.35 0.25 Allowed 'General case' 0 C--N 1.293 -1.884 0 O-C-N 120.696 -1.252 . . . . 0.0 109.9 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 31.2 t80 -127.68 57.53 1.52 Allowed 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.921 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.48 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 CA-C-O 121.717 0.77 . . . . 0.0 111.403 -178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.619 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.86 146.12 35.86 Favored 'General case' 0 N--CA 1.504 2.266 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.36 74.69 3.33 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 116.623 -2.031 . . . . 0.0 109.974 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -63.66 0.14 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 101.962 -3.347 . . . . 0.0 101.962 172.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 26.2 p -114.22 80.42 1.39 Allowed 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 112.356 -2.202 . . . . 0.0 105.108 176.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.2 16.99 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 -176.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.05 -36.23 17.08 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 119.687 -1.883 . . . . 0.0 112.691 -178.606 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.545 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.6 tp60 -159.47 139.59 11.9 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 119.295 -2.128 . . . . 0.0 115.138 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.619 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.2 tp -141.33 168.83 18.85 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.43 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 63.9 m-20 -148.25 140.24 23.99 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.156 -0.965 . . . . 0.0 109.092 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.691 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 4.6 ptpp? -57.6 -19.65 27.35 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.394 -0.816 . . . . 0.0 109.636 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.3 -17.22 57.72 Favored Glycine 0 N--CA 1.485 1.96 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.11 25.35 4.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.943 -0.739 . . . . 0.0 109.422 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.519 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -90.12 114.45 26.39 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-O 122.283 1.04 . . . . 0.0 109.408 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.474 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -106.16 167.1 10.04 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 179.074 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.7 tt0 -153.48 157.54 40.0 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.618 -1.301 . . . . 0.0 111.323 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.54 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.2 tp-100 -156.81 146.21 20.5 Favored 'General case' 0 C--N 1.295 -1.785 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 178.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.589 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 47.07 23.55 0.3 Allowed 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.939 -1.101 . . . . 0.0 109.609 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.9 m-20 81.51 -6.0 1.54 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.759 -0.588 . . . . 0.0 110.973 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -88.17 118.1 69.17 Favored Pre-proline 0 C--N 1.295 -1.789 0 O-C-N 121.16 -0.963 . . . . 0.0 110.005 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.542 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.1 Cg_exo -49.87 164.45 0.4 Allowed 'Trans proline' 0 N--CA 1.489 1.257 0 CA-C-N 119.988 1.031 . . . . 0.0 111.855 179.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.542 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 27.9 m-85 -170.73 137.98 1.36 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.276 -0.89 . . . . 0.0 109.877 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.06 156.6 35.66 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 105.071 -2.196 . . . . 0.0 105.071 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.555 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.61 -56.4 20.24 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 105.79 -1.93 . . . . 0.0 105.79 178.526 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -45.46 -28.63 0.94 Allowed 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 21.1 m -84.14 -65.88 0.96 Allowed 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.449 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.7 OUTLIER -45.6 -52.29 10.83 Favored 'General case' 0 N--CA 1.494 1.749 0 CA-C-O 121.594 0.712 . . . . 0.0 109.583 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.64 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -59.9 -40.95 90.51 Favored 'General case' 0 C--N 1.293 -1.854 0 O-C-N 121.574 -0.704 . . . . 0.0 109.393 -178.489 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.61 ' O ' HG21 ' A' ' 75' ' ' THR . 17.4 tptm -57.46 -26.27 60.97 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.157 -0.965 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.518 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -93.73 -56.66 2.82 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.028 -1.045 . . . . 0.0 111.123 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.5 ' CG ' ' NE2' ' B' ' 590' ' ' GLN . 0.3 OUTLIER -100.5 -29.62 12.26 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.178 -0.951 . . . . 0.0 110.727 -178.112 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.439 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 2.4 t . . . . . 0 N--CA 1.501 2.102 0 O-C-N 121.048 -1.033 . . . . 0.0 109.682 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ttt . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.94 -52.46 0.1 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 70.8 mt -48.33 -81.33 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 122.211 1.005 . . . . 0.0 109.192 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.408 ' O ' ' CG ' ' A' ' 4' ' ' ASP . 26.2 t70 50.32 18.75 0.45 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-O 121.745 0.783 . . . . 0.0 109.299 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -60.79 -16.86 48.11 Favored Glycine 0 N--CA 1.485 1.901 0 N-CA-C 107.323 -2.311 . . . . 0.0 107.323 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.733 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -107.07 -94.23 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 -179.527 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.595 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -155.01 -102.45 0.04 OUTLIER 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.163 -0.96 . . . . 0.0 110.061 -179.827 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.595 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -149.48 -62.47 0.02 OUTLIER Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 120.976 -1.077 . . . . 0.0 111.531 -178.417 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -42.89 -36.59 5.38 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 CA-C-N 121.034 1.405 . . . . 0.0 110.66 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.406 ' HB3' ' HE ' ' A' ' 7' ' ' ARG . 21.7 t70 -115.36 -25.23 8.06 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -90.71 11.24 72.34 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.3 -1.52 . . . . 0.0 109.3 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 8' ' ' MET . 49.2 t -164.96 -81.04 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.613 -0.933 . . . . 0.0 110.082 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.671 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 1.6 t80 78.29 -42.25 0.34 Allowed 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -178.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.671 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 163.73 -53.51 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -163.98 4.45 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.63 0 C-N-CA 119.475 -0.89 . . . . 0.0 110.461 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.51 25.66 6.86 Favored Glycine 0 N--CA 1.496 2.699 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.6 p -90.19 122.53 33.21 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.454 -1.027 . . . . 0.0 109.544 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.65 121.44 32.15 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.606 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.7 128.73 35.82 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.161 -0.962 . . . . 0.0 109.073 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.484 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -83.45 135.03 34.83 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 179.246 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.07 145.85 35.58 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.399 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.7 t -137.81 111.07 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 CA-C-O 121.923 0.868 . . . . 0.0 109.756 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.514 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 6.9 m-70 -85.8 103.59 14.71 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.1 t -73.03 82.8 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 O-C-N 121.159 -0.963 . . . . 0.0 109.192 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.492 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.62 166.4 0.93 Allowed 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 179.77 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' A' ' 25' ' ' THR . 8.5 t0 73.48 -46.3 0.63 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 106.451 -1.685 . . . . 0.0 106.451 -177.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.575 HD12 ' HD2' ' A' ' 29' ' ' ARG . 0.3 OUTLIER -85.76 -36.34 20.2 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.345 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 75.72 13.28 2.91 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -178.339 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.575 ' HD2' HD12 ' A' ' 27' ' ' LEU . 43.5 mtp180 -90.41 -177.81 5.18 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.12 -0.988 . . . . 0.0 109.144 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.514 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 18.1 m-20 -144.45 116.87 8.54 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 32' ' ' THR . 19.9 t -119.41 157.4 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 CA-C-O 121.693 0.759 . . . . 0.0 110.062 -178.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.424 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.12 133.01 42.34 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD22 ' C ' ' A' ' 32' ' ' THR . 2.7 mm? -113.84 113.24 24.63 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.705 -0.622 . . . . 0.0 109.334 -179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -59.95 105.95 0.45 Allowed 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.431 ' HB ' HG11 ' A' ' 39' ' ' VAL . 18.1 m -134.25 -169.51 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-O 121.988 0.899 . . . . 0.0 110.4 -178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.3 p -142.5 174.64 10.45 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.09 44.65 2.65 Favored Glycine 0 N--CA 1.485 1.928 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.452 ' C ' HG21 ' A' ' 78' ' ' THR . 0.0 OUTLIER -145.58 4.07 1.01 Allowed 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.602 -0.94 . . . . 0.0 108.956 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.597 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -88.9 137.72 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.073 -1.017 . . . . 0.0 110.193 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.482 ' O ' ' N ' ' A' ' 43' ' ' GLY . 3.8 m-70 -79.25 144.38 34.39 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.138 -0.976 . . . . 0.0 108.912 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 87.9 mt -45.74 -58.54 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.257 -0.902 . . . . 0.0 110.175 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -55.07 -13.58 4.93 Favored Glycine 0 C--N 1.296 -1.677 0 N-CA-C 108.734 -1.746 . . . . 0.0 108.734 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.95 -26.33 58.47 Favored Glycine 0 N--CA 1.48 1.621 0 N-CA-C 108.54 -1.824 . . . . 0.0 108.54 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.2 t -83.32 -53.95 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.469 -1.018 . . . . 0.0 110.642 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -27.68 44.09 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.222 -1.549 . . . . 0.0 108.862 -179.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -64.13 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -52.28 -53.99 37.07 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.431 -0.793 . . . . 0.0 110.17 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.5 tp -44.93 -51.52 9.66 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.508 -0.745 . . . . 0.0 110.098 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.4 t -65.81 -47.13 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.815 -1.178 . . . . 0.0 109.008 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -48.03 -40.62 23.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.275 -0.891 . . . . 0.0 109.474 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -69.21 -43.87 73.23 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.406 -0.809 . . . . 0.0 110.011 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.41 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -48.96 -58.1 5.43 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.566 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.41 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.4 t70 74.0 75.47 0.12 Allowed 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.938 0.875 . . . . 0.0 110.135 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.493 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -175.16 132.89 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.292 -1.905 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.593 ' HB3' HD21 ' B' ' 579' ' ' LEU . 7.1 mmtt -69.46 35.86 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.593 0 O-C-N 121.458 -0.776 . . . . 0.0 109.381 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.539 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 39.4 tttp -78.95 135.42 36.94 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.628 -1.295 . . . . 0.0 108.681 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.406 ' O ' ' CE1' ' A' ' 61' ' ' HIS . 14.3 t70 -50.02 119.72 3.83 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.223 -0.923 . . . . 0.0 108.958 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 55.1 m95 -120.23 -35.93 3.34 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.58 -0.7 . . . . 0.0 110.539 -179.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 58' ' ' TRP . 8.2 t -43.15 -50.27 6.28 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.293 -0.879 . . . . 0.0 109.164 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -55.52 -43.06 75.38 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.603 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.4 OUTLIER -71.16 115.15 9.97 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.582 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -129.56 168.99 15.58 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.624 ' O ' HD12 ' A' ' 63' ' ' LEU . 0.3 OUTLIER -95.71 149.37 21.55 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-O 122.289 1.042 . . . . 0.0 110.679 -178.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.623 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -141.6 142.87 33.46 Favored 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 -178.71 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.696 ' HB2' HD21 ' A' ' 72' ' ' LEU . 5.1 t90 -94.96 90.8 6.1 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.292 -1.505 . . . . 0.0 108.955 -178.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.416 ' C ' ' N ' ' A' ' 68' ' ' LYS . 14.3 pt-20 -55.44 -23.46 25.41 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.069 -1.019 . . . . 0.0 110.585 -179.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.483 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 12.6 mmtp -66.53 -10.4 44.57 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.416 ' N ' ' C ' ' A' ' 66' ' ' GLU . 17.7 mmtt -133.29 -11.08 2.87 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.616 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.3 mpp_? 52.73 47.18 25.24 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 4.0 t -115.43 -172.15 2.09 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.472 0.653 . . . . 0.0 109.834 -178.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.56 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -129.8 99.21 5.04 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 177.02 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.696 HD21 ' HB2' ' A' ' 65' ' ' TRP . 0.5 OUTLIER -62.38 87.72 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.182 0 O-C-N 120.667 -1.271 . . . . 0.0 108.832 -176.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.505 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 13.01 12.55 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.96 74.72 9.67 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.83 -25.22 68.07 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.909 -1.12 . . . . 0.0 108.354 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.48 ' O ' ' CE3' ' A' ' 77' ' ' TRP . 2.8 t60 -82.83 73.71 9.84 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.48 ' CE3' ' O ' ' A' ' 76' ' ' HIS . 0.1 OUTLIER 161.04 -167.77 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.409 -1.7 . . . . 0.0 106.409 -179.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.68 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -149.44 -172.0 4.03 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.776 -1.202 . . . . 0.0 109.432 -179.756 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -62.49 -58.82 6.24 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -42.95 -50.98 5.77 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.695 0.76 . . . . 0.0 109.874 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.68 ' CG ' ' H ' ' A' ' 78' ' ' THR . 18.2 mmtp -46.54 -54.39 9.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-O 121.58 0.705 . . . . 0.0 109.684 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -73.71 -41.11 63.04 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.117 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 114.11 8.8 16.83 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 108.131 -1.988 . . . . 0.0 108.131 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 58.9 mt -61.07 157.94 2.77 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 O-C-N 121.755 -0.85 . . . . 0.0 109.135 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.16 -165.78 1.04 Allowed 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.61 -24.85 63.71 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.468 -0.77 . . . . 0.0 110.022 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 9.4 p30 -78.6 -7.98 58.15 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 108.769 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.54 113.61 26.12 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.0 mmtp -93.82 116.02 28.46 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 120.982 -1.074 . . . . 0.0 110.018 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.484 ' HG ' HD12 ' A' ' 20' ' ' LEU . 12.2 mt -91.16 176.65 6.51 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 178.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.623 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 6.9 mt-30 -135.6 171.73 14.03 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -141.54 97.62 3.19 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.417 ' CB ' ' OG1' ' A' ' 25' ' ' THR . 3.0 t -160.99 151.65 15.16 Favored Pre-proline 0 N--CA 1.491 1.582 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.85 -177.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo . . . . . 0 N--CA 1.493 1.455 0 C-N-CA 122.766 2.311 . . . . 0.0 112.408 178.417 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . 0.4 ' C ' ' H ' ' B' ' 544' ' ' ARG . 0.9 OUTLIER -123.35 -52.6 1.83 Allowed 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.877 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.467 ' O ' ' O ' ' B' ' 544' ' ' ARG . 4.0 pt-20 -76.01 9.94 2.17 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.565 ' CG ' HH21 ' B' ' 544' ' ' ARG . 0.1 OUTLIER 37.39 -164.0 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.239 0 CA-C-O 121.179 0.514 . . . . 0.0 111.615 178.977 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.41 -164.55 0.93 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.377 -0.827 . . . . 0.0 110.024 -178.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -91.06 -94.83 1.27 Allowed Glycine 0 N--CA 1.496 2.655 0 N-CA-C 109.838 -1.305 . . . . 0.0 109.838 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.531 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.0 m -157.19 116.68 3.39 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.86 136.39 57.96 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.089 -1.007 . . . . 0.0 110.407 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.489 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.61 103.9 13.3 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.245 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -51.1 126.96 17.83 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 122.198 0.999 . . . . 0.0 109.641 -177.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.53 -34.56 5.42 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.172 -2.771 . . . . 0.0 106.172 -177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.73 -35.47 7.36 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 178.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.457 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.3 mm-40 55.08 56.22 6.79 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-O 122.742 1.258 . . . . 0.0 110.025 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -141.02 125.02 10.31 Favored Pre-proline 0 C--N 1.293 -1.856 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -44.24 137.65 7.5 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 CA-C-N 120.372 1.169 . . . . 0.0 114.993 -178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.531 ' N ' ' O ' ' B' ' 547' ' ' SER . 43.8 mt -96.58 98.72 7.94 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 107.859 -1.163 . . . . 0.0 107.859 179.007 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 71.8 p -99.84 93.41 5.78 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.234 -0.916 . . . . 0.0 111.356 -177.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 153.25 -95.4 0.15 Allowed Glycine 0 N--CA 1.487 2.082 0 N-CA-C 107.406 -2.278 . . . . 0.0 107.406 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.477 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.29 152.48 31.3 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 177.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.1 p -144.48 126.19 15.16 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.012 -1.055 . . . . 0.0 111.265 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.8 mt -90.6 146.5 6.12 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.78 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.8 m -118.51 146.74 44.3 Favored 'General case' 0 C--N 1.291 -1.938 0 CA-C-O 121.888 0.852 . . . . 0.0 109.049 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.85 -129.0 0.25 Allowed 'General case' 0 C--N 1.295 -1.79 0 CA-C-O 121.607 0.718 . . . . 0.0 109.407 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.552 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 14.1 mtp -65.57 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.02 -8.75 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 -178.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -81.84 159.93 23.62 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt -102.91 174.47 5.86 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 178.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.69 136.18 8.01 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 118.231 -1.388 . . . . 0.0 109.957 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.588 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -55.79 115.81 10.52 Favored Pre-proline 0 C--N 1.3 -1.567 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 177.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.7 Cg_exo -46.22 -8.95 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.452 0 CA-C-N 120.353 1.162 . . . . 0.0 111.814 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.921 ' O ' HG13 ' B' ' 574' ' ' VAL . 12.2 mt-10 -100.64 -52.84 3.23 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 122.021 0.915 . . . . 0.0 110.06 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.474 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.2 m170 -57.03 -4.7 0.19 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.848 -1.157 . . . . 0.0 109.863 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.457 ' H ' ' C ' ' B' ' 571' ' ' GLU . 19.6 t80 -124.77 54.53 1.4 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 178.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.921 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -93.74 177.6 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.827 0.823 . . . . 0.0 110.738 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.588 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -76.9 149.33 36.07 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -96.35 76.07 2.95 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 116.787 -1.965 . . . . 0.0 110.736 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -152.84 -56.97 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 101.645 -3.465 . . . . 0.0 101.645 172.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.8 p -117.21 121.99 42.74 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 112.535 -2.121 . . . . 0.0 106.772 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 55' ' ' LYS . 10.8 mp -75.01 14.19 0.56 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 121.05 -1.031 . . . . 0.0 111.981 -177.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -92.27 -39.5 11.48 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 119.361 -2.087 . . . . 0.0 115.277 -175.802 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -162.72 141.57 8.79 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 122.513 2.415 . . . . 0.0 116.332 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' B' ' 575' ' ' CYS . 19.7 tp -142.04 168.69 19.15 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 174.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.504 ' O ' ' N ' ' B' ' 587' ' ' PHE . 72.2 m-20 -149.82 135.86 18.76 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.917 -1.114 . . . . 0.0 109.048 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.78 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 1.2 ptpp? -54.87 -14.37 1.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.21 -0.931 . . . . 0.0 109.111 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . 0.408 ' N ' ' C ' ' B' ' 583' ' ' ASN . . . -94.72 -15.5 45.93 Favored Glycine 0 N--CA 1.486 2.019 0 N-CA-C 108.735 -1.746 . . . . 0.0 108.735 -179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.1 p -136.72 26.17 3.07 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.907 -0.76 . . . . 0.0 108.983 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 2.2 p90 -89.25 108.18 19.47 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-O 122.446 1.117 . . . . 0.0 109.338 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.56 165.63 11.53 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 107.124 -1.436 . . . . 0.0 107.124 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.429 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 14.2 tt0 -153.2 157.29 40.02 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 122.656 1.217 . . . . 0.0 110.718 -178.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.507 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -156.56 145.96 20.62 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.592 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 46.79 23.58 0.27 Allowed 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.037 -1.039 . . . . 0.0 109.497 -179.642 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.48 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 82.55 -7.19 1.29 Allowed 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.818 -0.551 . . . . 0.0 110.865 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -87.83 116.45 66.2 Favored Pre-proline 0 C--N 1.295 -1.763 0 O-C-N 121.123 -0.986 . . . . 0.0 110.067 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 31.3 Cg_exo -50.26 164.34 0.49 Allowed 'Trans proline' 0 N--CA 1.488 1.176 0 CA-C-N 120.026 1.045 . . . . 0.0 111.698 179.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 24.2 m-85 -170.4 140.5 1.83 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.259 -0.901 . . . . 0.0 109.837 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.7 m -69.63 154.72 41.59 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 104.839 -2.282 . . . . 0.0 104.839 175.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.539 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.7 -56.97 15.34 Favored 'General case' 0 C--N 1.293 -1.859 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 178.481 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -46.31 -30.04 1.9 Allowed 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 6.6 m -81.24 -63.14 1.46 Allowed 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.554 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.48 -54.34 28.07 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.437 0.637 . . . . 0.0 110.375 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.692 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -52.78 -41.8 64.44 Favored 'General case' 0 C--N 1.297 -1.715 0 O-C-N 121.375 -0.828 . . . . 0.0 109.902 -178.07 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.83 -23.22 66.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.031 -1.043 . . . . 0.0 110.719 -179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.453 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.3 OUTLIER -91.86 -56.3 3.14 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.571 -1.331 . . . . 0.0 111.915 -177.09 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.449 ' C ' ' SG ' ' B' ' 605' ' ' CYS . 0.3 OUTLIER -103.7 4.77 35.72 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.185 -0.947 . . . . 0.0 111.155 -177.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.449 ' SG ' ' C ' ' B' ' 604' ' ' PHE . 2.1 m . . . . . 0 N--CA 1.498 1.95 0 O-C-N 120.714 -1.241 . . . . 0.0 109.445 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttm . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.84 -43.99 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.103 -0.998 . . . . 0.0 108.774 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.899 ' H ' HD12 ' A' ' 3' ' ' LEU . 5.6 mp -58.85 -66.47 0.49 Allowed 'General case' 0 C--N 1.301 -1.532 0 CA-C-O 122.175 0.988 . . . . 0.0 109.111 179.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -74.49 18.66 0.15 Allowed 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.501 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -59.72 -15.87 35.67 Favored Glycine 0 N--CA 1.488 2.103 0 N-CA-C 108.016 -2.034 . . . . 0.0 108.016 179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.692 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -106.85 -98.64 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.681 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -179.13 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.545 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -152.69 -99.34 0.05 Allowed 'General case' 0 N--CA 1.486 1.342 0 O-C-N 120.816 -1.177 . . . . 0.0 109.872 -179.626 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.545 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -145.5 -62.13 0.02 OUTLIER Pre-proline 0 N--CA 1.5 2.069 0 O-C-N 120.948 -1.095 . . . . 0.0 110.763 -179.111 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -43.28 -33.81 4.13 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 CA-C-N 121.017 1.399 . . . . 0.0 110.24 178.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -116.57 -27.05 6.84 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.91 -1.041 . . . . 0.0 108.534 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.45 5.4 68.54 Favored Glycine 0 N--CA 1.486 2.013 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 9.7 t -172.26 -55.19 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.356 -1.085 . . . . 0.0 110.154 -179.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.643 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 1.5 t80 78.21 -45.44 0.41 Allowed 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 -178.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.643 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 151.99 -27.62 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -174.79 -21.71 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 112.86 14.46 10.15 Favored Glycine 0 N--CA 1.499 2.838 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.541 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.1 OUTLIER -98.61 126.84 44.32 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.383 -1.069 . . . . 0.0 109.839 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.5 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.5 OUTLIER -128.58 123.86 34.46 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.296 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.611 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -76.83 137.75 39.41 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.256 -0.903 . . . . 0.0 109.561 -179.465 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -85.23 129.17 34.86 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.06 143.29 37.55 Favored 'General case' 0 C--N 1.296 -1.733 0 O-C-N 120.882 -1.136 . . . . 0.0 108.353 179.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.4 t -136.47 153.24 30.61 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 CA-C-O 121.65 0.738 . . . . 0.0 109.415 179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.464 ' H ' ' HA ' ' A' ' 91' ' ' GLN . 24.5 m80 -123.26 102.16 7.78 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.005 -1.479 . . . . 0.0 107.005 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.96 102.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.503 ' C ' ' H ' ' A' ' 27' ' ' LEU . 53.9 p -75.72 -35.39 60.26 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.34 -0.85 . . . . 0.0 109.675 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -76.01 19.05 0.24 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.181 -0.95 . . . . 0.0 108.496 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.503 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -154.74 -28.51 0.11 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.627 -0.671 . . . . 0.0 109.203 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.2 OUTLIER 82.97 12.64 0.46 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 122.135 -0.353 . . . . 0.0 110.199 -179.534 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -95.27 -178.32 4.41 Favored 'General case' 0 C--N 1.309 -1.181 0 O-C-N 120.85 -1.157 . . . . 0.0 109.881 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.421 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 1.3 m-20 -138.44 121.04 16.22 Favored 'General case' 0 C--N 1.295 -1.799 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.7 t -119.46 154.58 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.788 0.804 . . . . 0.0 110.577 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.473 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -130.8 128.89 41.62 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.811 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 32' ' ' THR . 3.0 mm? -115.1 115.31 26.58 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.39 0.614 . . . . 0.0 110.034 -178.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.541 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.7 tpt180 -59.62 112.29 1.74 Allowed 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.5 m -140.73 -171.21 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.983 0.897 . . . . 0.0 110.461 -179.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 p -144.43 176.22 9.54 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.85 44.57 3.14 Favored Glycine 0 N--CA 1.481 1.681 0 N-CA-C 109.042 -1.623 . . . . 0.0 109.042 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.502 ' C ' HG21 ' A' ' 78' ' ' THR . 3.4 pt-20 -145.61 1.68 0.92 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.589 -0.948 . . . . 0.0 108.881 178.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.457 ' O ' HG22 ' A' ' 78' ' ' THR . 1.4 m -89.14 134.0 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 O-C-N 120.939 -1.101 . . . . 0.0 109.547 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.46 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.8 m-70 -73.45 147.37 44.22 Favored 'General case' 0 C--N 1.29 -2.001 0 O-C-N 120.948 -1.095 . . . . 0.0 108.175 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.434 ' C ' ' N ' ' A' ' 43' ' ' GLY . 81.6 mt -48.75 -51.39 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 120.998 -1.064 . . . . 0.0 108.947 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -57.52 -10.87 6.42 Favored Glycine 0 N--CA 1.486 2.011 0 N-CA-C 108.482 -1.847 . . . . 0.0 108.482 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -74.93 -26.82 65.88 Favored Glycine 0 N--CA 1.483 1.773 0 N-CA-C 107.919 -2.073 . . . . 0.0 107.919 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 45' ' ' MET . 2.1 t -84.13 -42.95 17.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.404 ' C ' ' O ' ' A' ' 44' ' ' VAL . 40.9 mtm -45.51 -36.25 4.4 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -72.26 -65.81 0.73 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-O 121.398 0.618 . . . . 0.0 110.095 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 48.2 mttm -52.88 -55.67 21.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.446 -0.783 . . . . 0.0 111.275 -178.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 47' ' ' LYS . 0.5 OUTLIER -45.05 -56.69 4.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.946 -1.097 . . . . 0.0 109.759 -178.524 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.5 t -60.64 -47.36 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.04 -1.037 . . . . 0.0 110.117 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -45.06 -39.63 5.96 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.153 -0.967 . . . . 0.0 109.85 -179.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -65.52 -57.06 9.13 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.318 -0.864 . . . . 0.0 110.392 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -67.17 0.45 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 15.4 t0 62.62 89.03 0.09 Allowed 'General case' 0 C--N 1.301 -1.503 0 CA-C-O 121.863 0.839 . . . . 0.0 109.242 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.704 ' O ' HG22 ' A' ' 54' ' ' VAL . 1.6 p -155.67 33.13 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.281 -2.376 0 C-N-CA 119.045 -1.062 . . . . 0.0 110.303 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 tptt 41.23 17.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.778 -0.576 . . . . 0.0 110.649 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.576 ' N ' ' O ' ' A' ' 54' ' ' VAL . 16.7 ttmm -78.7 146.72 33.81 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.967 -1.083 . . . . 0.0 109.027 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.53 115.09 2.12 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.509 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 60.4 m95 -117.72 -33.66 4.46 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.609 -0.682 . . . . 0.0 109.905 -179.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.5 t -42.99 -55.78 3.62 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.433 -0.792 . . . . 0.0 110.271 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -50.99 -43.65 60.76 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.211 -0.93 . . . . 0.0 108.521 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 8.5 m80 -72.45 134.17 45.21 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.732 0.777 . . . . 0.0 110.214 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.86 -179.31 6.51 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.833 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -95.12 137.73 33.77 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.812 -1.18 . . . . 0.0 110.682 -179.384 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.498 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -125.88 148.97 49.03 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 179.662 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.555 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.1 t90 -105.13 92.08 4.07 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 120.711 -1.243 . . . . 0.0 108.708 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -54.31 -23.57 15.75 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.255 -0.903 . . . . 0.0 110.734 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.514 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 23.7 mmtp -67.82 -10.56 53.95 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -134.0 -11.43 2.6 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.132 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.555 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.63 45.84 27.86 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.4 t -111.93 -171.05 1.77 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.322 0.582 . . . . 0.0 109.804 -178.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.551 ' N ' ' CD1' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.56 99.68 5.46 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 177.608 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.41 ' HB3' HD13 ' A' ' 41' ' ' ILE . 36.1 mt -60.07 88.47 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 122.69 1.233 . . . . 0.0 110.634 -176.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.476 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.0 pp -123.04 13.04 9.71 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 107.462 -1.311 . . . . 0.0 107.462 178.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' A' ' 76' ' ' HIS . 10.1 mmpt? -75.37 43.18 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.735 -0.603 . . . . 0.0 109.966 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.686 HG21 ' O ' ' B' ' 602' ' ' LYS . 3.7 m -54.75 -6.37 0.12 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.982 -1.074 . . . . 0.0 109.58 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.48 ' H ' ' C ' ' A' ' 74' ' ' LYS . 87.2 m-70 -55.97 -68.57 0.19 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.252 -0.905 . . . . 0.0 110.861 -179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -99.05 -115.86 0.15 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.137 -0.977 . . . . 0.0 110.636 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.502 HG21 ' C ' ' A' ' 38' ' ' GLU . 0.1 OUTLIER -153.41 155.44 36.37 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.658 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.2 pt? -43.8 -51.1 7.58 Favored 'General case' 0 C--N 1.295 -1.78 0 O-C-N 121.275 -0.89 . . . . 0.0 110.654 179.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.438 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 17.6 t70 -45.49 -32.25 2.13 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.213 -0.929 . . . . 0.0 109.852 178.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.554 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -72.55 -32.01 65.72 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 -179.623 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.554 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.5 OUTLIER -73.33 -49.55 26.79 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 179.082 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 124.28 4.55 7.64 Favored Glycine 0 N--CA 1.51 3.619 0 N-CA-C 108.65 -1.78 . . . . 0.0 108.65 179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 55.9 mt -60.08 162.29 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.287 -2.111 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -156.22 -164.64 1.73 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.048 -1.033 . . . . 0.0 108.741 178.697 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 18' ' ' TRP . . . -73.57 -21.27 60.4 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.175 -0.953 . . . . 0.0 109.833 179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.1 3.24 43.46 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.335 -0.853 . . . . 0.0 109.402 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.475 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.98 113.61 25.34 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.355 -0.841 . . . . 0.0 109.315 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -97.39 125.77 42.23 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.059 -1.026 . . . . 0.0 109.228 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.6 mt -112.7 178.61 4.23 Favored 'General case' 0 N--CA 1.502 2.146 0 CA-C-O 121.714 0.769 . . . . 0.0 109.388 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.498 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.2 mt-30 -129.9 168.19 17.01 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -123.73 90.88 3.35 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 178.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.53 169.26 9.81 Favored Pre-proline 0 N--CA 1.5 2.061 0 O-C-N 121.737 -0.602 . . . . 0.0 110.332 -176.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo . . . . . 0 N--CA 1.493 1.494 0 C-N-CA 123.193 2.595 . . . . 0.0 112.643 179.0 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . 0.4 ' ND1' ' N ' ' B' ' 542' ' ' HIS . 1.4 m-70 -53.11 -79.97 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.141 -0.974 . . . . 0.0 109.276 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.439 ' CG ' ' H ' ' B' ' 544' ' ' ARG . 0.7 OUTLIER -134.05 -98.89 0.26 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.149 -0.969 . . . . 0.0 108.957 179.711 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.439 ' H ' ' CG ' ' B' ' 543' ' ' GLU . 10.4 mpt_? -82.8 -93.82 0.06 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.249 -0.907 . . . . 0.0 111.062 -179.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.576 ' NE ' ' H ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -87.6 -106.02 0.07 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.126 -0.984 . . . . 0.0 110.614 -178.123 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . 0.576 ' H ' ' NE ' ' B' ' 545' ' ' ARG . . . 162.29 -94.83 0.13 Allowed Glycine 0 N--CA 1.492 2.429 0 N-CA-C 108.992 -1.643 . . . . 0.0 108.992 -179.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.543 ' O ' ' N ' ' B' ' 556' ' ' ILE . 3.1 m -152.35 113.78 4.29 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 179.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -61.18 137.13 58.24 Favored 'General case' 0 C--N 1.295 -1.783 0 O-C-N 121.23 -0.919 . . . . 0.0 110.653 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.55 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.86 103.84 13.46 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 178.197 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.5 t -49.62 125.99 12.66 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 122.086 0.946 . . . . 0.0 109.624 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.33 -34.95 5.2 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 106.444 -2.663 . . . . 0.0 106.444 -177.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.7 m -105.17 -35.29 7.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.457 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.6 mm-40 55.01 56.27 6.77 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-O 122.694 1.235 . . . . 0.0 109.899 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt -140.83 124.7 10.34 Favored Pre-proline 0 C--N 1.294 -1.813 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -43.7 138.29 5.8 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 CA-C-N 120.428 1.189 . . . . 0.0 114.83 -178.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.55 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.6 mt -97.61 98.69 7.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.421 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 51.8 p -100.06 91.35 4.74 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-O 121.955 0.883 . . . . 0.0 111.234 -177.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.41 -96.66 0.16 Allowed Glycine 0 N--CA 1.488 2.102 0 N-CA-C 107.349 -2.3 . . . . 0.0 107.349 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.484 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 6.0 mmt-85 -113.08 153.02 28.84 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.5 p -144.83 126.47 15.13 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.022 -1.049 . . . . 0.0 111.425 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 55.4 mt -90.61 146.15 6.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 178.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 10.9 m -121.5 146.61 46.75 Favored 'General case' 0 C--N 1.289 -2.024 0 CA-C-O 122.0 0.905 . . . . 0.0 109.151 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.738 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.27 -128.92 0.26 Allowed 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.562 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.9 mtp -65.75 25.88 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.738 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.0 -8.56 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.537 -1.653 . . . . 0.0 106.537 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.84 149.07 28.5 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.5 mmmt -96.02 174.72 6.78 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.43 134.67 7.3 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 118.436 -1.306 . . . . 0.0 109.939 -178.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.581 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.2 m80 -55.42 114.8 7.87 Favored Pre-proline 0 C--N 1.303 -1.428 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 177.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.577 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 47.1 Cg_exo -45.67 -10.68 0.05 OUTLIER 'Trans proline' 0 C--N 1.308 -1.562 0 CA-C-N 120.306 1.145 . . . . 0.0 111.964 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.745 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.9 mt-10 -100.64 -53.01 3.19 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 122.052 0.93 . . . . 0.0 110.067 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.499 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.7 m170 -55.41 -5.92 0.15 Allowed 'General case' 0 C--N 1.294 -1.843 0 O-C-N 120.589 -1.319 . . . . 0.0 109.839 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.471 ' H ' ' C ' ' B' ' 571' ' ' GLU . 21.2 t80 -124.27 52.53 1.49 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.745 HG13 ' O ' ' B' ' 571' ' ' GLU . 11.4 m -93.47 176.89 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 CA-C-O 121.514 0.673 . . . . 0.0 110.125 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.549 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.44 144.03 38.12 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 107.597 -1.261 . . . . 0.0 107.597 179.029 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -90.89 74.09 6.49 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 116.258 -2.177 . . . . 0.0 109.488 179.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -153.99 -65.85 0.14 Allowed 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 172.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.536 ' O ' ' N ' ' B' ' 580' ' ' LYS . 17.0 p -110.67 84.03 1.86 Allowed 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 112.514 -2.13 . . . . 0.0 105.616 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 0.857 HD22 ' N ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.49 15.1 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.67 -38.7 15.64 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 119.542 -1.973 . . . . 0.0 112.542 -178.267 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.577 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.25 142.16 9.82 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 119.5 -2.0 . . . . 0.0 115.02 178.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.549 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.7 tp -136.7 170.1 16.63 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 175.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.502 ' O ' ' N ' ' B' ' 587' ' ' PHE . 77.2 m-20 -145.2 129.26 17.52 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.066 -1.022 . . . . 0.0 109.145 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -50.84 -22.64 2.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.522 -0.736 . . . . 0.0 109.651 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -86.12 -18.1 59.89 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.004 -1.638 . . . . 0.0 109.004 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.9 p -133.12 26.31 4.22 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.568 ' O ' ' CD1' ' B' ' 587' ' ' PHE . 0.3 OUTLIER -89.48 108.53 19.7 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-O 122.579 1.18 . . . . 0.0 109.974 -179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.488 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.44 168.4 10.01 Favored 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.411 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.7 tt0 -152.46 157.15 40.77 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.747 -1.221 . . . . 0.0 110.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.532 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.6 tp60 -150.84 144.2 24.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.553 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 41.98 27.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.217 -0.927 . . . . 0.0 110.452 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 3.6 m-20 84.26 -8.37 0.98 Allowed 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.758 -0.588 . . . . 0.0 111.05 179.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 53.2 mttt -88.18 116.78 67.26 Favored Pre-proline 0 C--N 1.296 -1.732 0 O-C-N 121.162 -0.961 . . . . 0.0 109.973 -179.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.526 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 32.2 Cg_exo -50.2 163.93 0.54 Allowed 'Trans proline' 0 N--CA 1.492 1.434 0 CA-C-N 119.887 0.995 . . . . 0.0 112.576 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.526 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 21.6 m-85 -170.84 139.65 1.51 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.404 -0.81 . . . . 0.0 109.589 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 10.0 m -68.5 157.23 36.4 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 175.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.57 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.2 -55.58 32.05 Favored 'General case' 0 C--N 1.294 -1.836 0 C-N-CA 117.253 -1.779 . . . . 0.0 106.56 179.203 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -46.5 -31.28 2.64 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.331 -0.856 . . . . 0.0 109.182 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.28 -56.52 4.15 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.456 ' CD2' ' OE1' ' B' ' 590' ' ' GLN . 2.4 t80 -60.32 -53.53 56.56 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-O 121.443 0.64 . . . . 0.0 110.498 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.654 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -51.45 -43.34 62.06 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.117 -0.989 . . . . 0.0 109.431 -178.348 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.686 ' O ' HG21 ' A' ' 75' ' ' THR . 0.5 OUTLIER -58.82 -20.43 50.36 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.994 -1.066 . . . . 0.0 110.163 -179.208 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.409 ' N ' HD23 ' B' ' 603' ' ' LEU . 1.2 mt -91.98 -56.93 2.89 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.651 -1.28 . . . . 0.0 110.331 -178.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' C ' ' B' ' 605' ' ' CYS . 24.5 m-85 -106.41 32.36 4.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.508 -0.745 . . . . 0.0 109.935 -179.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' B' ' 604' ' ' PHE . 3.9 t . . . . . 0 N--CA 1.502 2.145 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.759 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 mtm . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 122.455 1.122 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -158.87 -45.56 0.06 Allowed 'General case' 0 C--N 1.293 -1.878 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.025 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.592 ' O ' ' CG ' ' A' ' 4' ' ' ASP . 25.9 mt -51.81 -69.57 0.11 Allowed 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.545 -0.722 . . . . 0.0 109.951 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.592 ' CG ' ' O ' ' A' ' 3' ' ' LEU . 2.6 p30 63.08 -44.26 0.21 Allowed 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.656 -177.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.476 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 110.05 -15.56 30.8 Favored Glycine 0 N--CA 1.494 2.501 0 N-CA-C 108.914 -1.675 . . . . 0.0 108.914 178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.533 ' N ' ' OD2' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -114.22 -106.89 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -179.247 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.499 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -156.05 -96.81 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.336 -1.477 . . . . 0.0 110.227 -179.671 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.57 ' O ' ' N ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -131.83 -53.62 0.03 OUTLIER Pre-proline 0 N--CA 1.508 2.458 0 O-C-N 120.924 -1.11 . . . . 0.0 111.554 -179.05 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -58.31 -36.3 97.81 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 CA-C-N 121.079 1.421 . . . . 0.0 110.216 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -107.24 -25.92 11.28 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.11 -7.11 83.89 Favored Glycine 0 N--CA 1.487 2.039 0 N-CA-C 108.861 -1.696 . . . . 0.0 108.861 179.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.594 ' SG ' ' N ' ' A' ' 13' ' ' TYR . 12.4 t -159.38 -103.21 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.595 -0.944 . . . . 0.0 109.166 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.594 ' N ' ' SG ' ' A' ' 12' ' ' CYS . 42.1 m-85 -164.92 -112.95 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.302 -0.874 . . . . 0.0 108.997 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -176.6 -38.35 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.185 -0.947 . . . . 0.0 109.39 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -144.89 1.33 0.99 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.357 -0.84 . . . . 0.0 109.708 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.22 36.42 45.48 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.534 ' OG1' ' N ' ' A' ' 18' ' ' TRP . 2.7 t -167.85 178.46 5.2 Favored 'General case' 0 C--N 1.285 -2.235 0 C-N-CA 117.548 -1.661 . . . . 0.0 111.693 -179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.534 ' N ' ' OG1' ' A' ' 17' ' ' THR . 0.5 OUTLIER -165.48 127.87 2.09 Favored 'General case' 0 C--N 1.277 -2.552 0 CA-C-N 113.286 -1.779 . . . . 0.0 108.673 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -83.78 132.21 34.85 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.961 -1.087 . . . . 0.0 109.521 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.488 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.86 133.51 34.73 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.174 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.15 145.73 35.49 Favored 'General case' 0 C--N 1.295 -1.797 0 C-N-CA 119.454 -0.898 . . . . 0.0 109.176 -179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.4 t -137.35 114.11 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 CA-C-O 121.7 0.762 . . . . 0.0 110.015 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -85.76 103.77 14.84 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.526 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -69.63 107.01 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 27' ' ' LEU . 41.5 p -78.2 -41.08 35.59 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.327 -0.858 . . . . 0.0 110.037 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -73.02 20.53 0.08 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.055 -1.028 . . . . 0.0 108.793 179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.7 mt -154.49 -33.0 0.1 Allowed 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 85.23 14.09 0.19 Allowed 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 120.707 0.289 . . . . 0.0 110.429 -179.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.0 mtp-105 -95.58 -178.27 4.35 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 120.911 -1.118 . . . . 0.0 110.036 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -135.86 116.98 14.39 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.1 t -115.36 155.13 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 CA-C-O 121.681 0.753 . . . . 0.0 110.004 -179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.46 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -134.37 131.59 38.45 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' O ' ' A' ' 32' ' ' THR . 2.1 mm? -118.54 115.91 25.57 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.53 ' O ' HG13 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -61.6 133.85 56.13 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.905 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.53 HG13 ' O ' ' A' ' 34' ' ' ARG . 13.9 m -160.7 -170.22 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.29 -2.019 0 CA-C-O 122.071 0.938 . . . . 0.0 110.012 -178.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.417 ' C ' ' H ' ' A' ' 38' ' ' GLU . 0.8 OUTLIER -142.13 171.16 14.43 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 179.047 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -77.58 45.04 2.33 Favored Glycine 0 C--N 1.293 -1.831 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.435 ' C ' HG21 ' A' ' 78' ' ' THR . 0.7 OUTLIER -144.99 3.49 1.06 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.765 -0.844 . . . . 0.0 108.926 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.577 ' O ' HG22 ' A' ' 78' ' ' THR . 2.6 m -90.1 135.69 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.041 -1.037 . . . . 0.0 110.076 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.445 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.8 OUTLIER -72.5 142.46 48.54 Favored 'General case' 0 C--N 1.291 -1.943 0 O-C-N 120.944 -1.098 . . . . 0.0 108.217 178.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.466 ' C ' ' N ' ' A' ' 43' ' ' GLY . 94.1 mt -47.8 -55.54 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.051 -1.031 . . . . 0.0 109.268 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.512 ' H ' HG23 ' A' ' 75' ' ' THR . . . -55.8 -8.9 2.32 Favored Glycine 0 N--CA 1.487 2.053 0 N-CA-C 108.531 -1.828 . . . . 0.0 108.531 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -75.12 -28.25 62.62 Favored Glycine 0 N--CA 1.484 1.869 0 N-CA-C 107.585 -2.206 . . . . 0.0 107.585 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.29 -40.88 16.53 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.475 ' O ' HG23 ' A' ' 49' ' ' VAL . 42.1 mtm -47.64 -35.02 8.73 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -73.57 -65.72 0.79 Allowed 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.745 -0.597 . . . . 0.0 109.954 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 53.5 mttm -49.39 -59.85 3.36 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.372 -0.83 . . . . 0.0 110.8 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.51 -55.56 6.06 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.016 -1.052 . . . . 0.0 109.39 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 45' ' ' MET . 70.0 t -56.5 -48.76 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.244 -0.91 . . . . 0.0 109.96 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -46.72 -40.71 13.87 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.053 -1.03 . . . . 0.0 109.591 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 80.4 mttt -76.6 -36.83 57.26 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.411 -0.805 . . . . 0.0 110.853 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.484 HD12 ' CG1' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -59.74 -65.01 0.75 Allowed 'General case' 0 C--N 1.305 -1.342 0 O-C-N 120.914 -1.116 . . . . 0.0 108.904 -179.533 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 67.16 79.25 0.23 Allowed 'General case' 0 N--CA 1.487 1.387 0 CA-C-O 121.822 0.82 . . . . 0.0 109.816 179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.562 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.7 p -171.03 146.06 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 C-N-CA 119.696 -0.802 . . . . 0.0 110.005 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.28 34.91 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.315 -0.866 . . . . 0.0 108.931 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.562 ' H ' ' C ' ' A' ' 54' ' ' VAL . 16.0 ttmm -77.74 161.49 27.67 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.127 -0.983 . . . . 0.0 108.873 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -77.13 90.64 3.66 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 109.027 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.464 ' O ' ' O ' ' A' ' 61' ' ' HIS . 11.1 m0 -72.8 -58.15 3.56 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.344 -0.848 . . . . 0.0 109.106 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.5 t -42.25 -56.87 2.76 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.288 0.565 . . . . 0.0 110.463 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -53.87 -45.99 71.16 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 58' ' ' TRP . 51.6 m170 -72.94 121.03 19.4 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.794 0.807 . . . . 0.0 110.127 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -134.45 177.96 7.36 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.843 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.2 mm? -94.45 140.47 29.78 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.894 -1.129 . . . . 0.0 109.705 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.488 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.49 151.37 48.93 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 -179.217 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.535 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -109.35 94.08 4.84 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.064 -1.022 . . . . 0.0 108.659 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.431 ' OE2' ' OE1' ' A' ' 91' ' ' GLN . 10.6 pt-20 -55.4 -23.42 24.61 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.327 -0.858 . . . . 0.0 110.886 -179.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.534 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 22.9 mmtp -69.34 -9.32 52.83 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.7 mmtt -133.63 -11.81 2.7 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.068 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.535 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.9 mpp_? 52.6 45.54 28.43 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -178.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -112.36 -172.32 2.02 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 121.441 0.639 . . . . 0.0 109.798 -178.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.535 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.79 99.65 5.63 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 177.391 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.1 mt -59.88 84.93 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.667 1.222 . . . . 0.0 110.73 -176.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.9 pp -121.92 10.39 10.17 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.527 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -84.66 33.47 0.52 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 -179.178 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.512 HG23 ' H ' ' A' ' 42' ' ' GLY . 24.0 m -49.63 -10.01 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.994 -1.066 . . . . 0.0 109.579 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.527 ' N ' ' O ' ' A' ' 74' ' ' LYS . 12.8 m80 -55.61 -15.05 2.5 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.187 -0.945 . . . . 0.0 109.89 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -138.07 -122.25 0.13 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.227 -0.921 . . . . 0.0 109.413 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.577 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -151.96 -164.53 2.0 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.15 -1.594 . . . . 0.0 111.11 -178.374 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.566 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.3 mp -71.53 -56.0 6.75 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -43.15 -48.52 6.38 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.667 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.501 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -57.15 -30.41 64.42 Favored 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.931 -178.59 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.501 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -88.76 -44.7 10.35 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.135 -0.978 . . . . 0.0 108.575 179.712 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 111.23 27.24 4.29 Favored Glycine 0 N--CA 1.501 3.005 0 N-CA-C 108.515 -1.834 . . . . 0.0 108.515 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.538 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 38.8 mt -82.61 160.96 3.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.6 0 O-C-N 121.788 -0.83 . . . . 0.0 109.614 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -166.65 -173.3 2.4 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.439 -0.788 . . . . 0.0 108.894 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.48 -22.65 67.03 Favored 'General case' 0 C--N 1.298 -1.673 0 O-C-N 121.466 -0.771 . . . . 0.0 110.137 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -79.26 -8.84 59.35 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.161 -0.962 . . . . 0.0 109.098 -179.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.488 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -100.04 113.73 26.54 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.562 -0.711 . . . . 0.0 109.099 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp -94.43 117.33 29.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.974 -1.079 . . . . 0.0 109.527 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.435 ' HG ' HD12 ' A' ' 20' ' ' LEU . 8.9 mt -95.7 176.89 5.98 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.484 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.9 mt-30 -131.88 168.13 18.39 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -122.38 91.9 3.6 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.3 171.65 7.2 Favored Pre-proline 0 N--CA 1.501 2.091 0 O-C-N 121.65 -0.656 . . . . 0.0 109.834 -177.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo . . . . . 0 N--CA 1.493 1.461 0 C-N-CA 122.753 2.302 . . . . 0.0 112.453 179.305 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 22.5 t80 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . 0.567 ' CG ' ' H ' ' B' ' 543' ' ' GLU . 17.1 t60 -130.18 -130.7 0.21 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.521 -0.737 . . . . 0.0 109.188 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.567 ' H ' ' CG ' ' B' ' 542' ' ' HIS . 9.6 tt0 64.86 105.37 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 122.481 1.134 . . . . 0.0 109.835 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.523 ' O ' ' C ' ' B' ' 545' ' ' ARG . 21.1 mmt180 -43.7 167.31 0.01 OUTLIER 'General case' 0 C--N 1.288 -2.084 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.752 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.523 ' C ' ' O ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER -6.77 -112.87 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -179.802 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -99.97 -108.23 2.95 Favored Glycine 0 N--CA 1.496 2.667 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -175.68 120.74 0.18 Allowed 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -57.28 135.18 56.46 Favored 'General case' 0 C--N 1.298 -1.663 0 O-C-N 120.742 -1.224 . . . . 0.0 110.523 -178.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.549 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.97 103.99 13.67 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 178.372 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.0 t -49.46 125.86 12.09 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 122.045 0.926 . . . . 0.0 109.786 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.27 -34.77 5.31 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 106.406 -2.678 . . . . 0.0 106.406 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -105.12 -35.75 7.51 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.444 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.21 56.45 6.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.736 1.255 . . . . 0.0 109.826 -178.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -140.63 123.89 10.14 Favored Pre-proline 0 C--N 1.294 -1.826 0 N-CA-C 106.881 -1.526 . . . . 0.0 106.881 177.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -43.84 134.42 7.84 Favored 'Trans proline' 0 N--CA 1.492 1.412 0 CA-C-N 120.429 1.189 . . . . 0.0 114.825 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.549 HD11 ' HA ' ' B' ' 549' ' ' CYS . 41.5 mt -93.02 99.99 10.58 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 67.1 p -101.45 93.14 5.24 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.241 -0.912 . . . . 0.0 111.22 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.5 -94.35 0.14 Allowed Glycine 0 N--CA 1.488 2.139 0 N-CA-C 107.323 -2.311 . . . . 0.0 107.323 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.471 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 8.8 mmt180 -115.88 152.47 33.33 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 177.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.2 p -144.78 126.9 15.61 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.981 -1.074 . . . . 0.0 111.5 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . 0.488 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 49.6 mt -91.02 146.27 6.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.688 ' H ' ' CE ' ' B' ' 584' ' ' LYS . 9.3 m -121.03 146.25 46.91 Favored 'General case' 0 C--N 1.291 -1.943 0 CA-C-O 121.939 0.876 . . . . 0.0 109.091 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.735 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.83 -128.87 0.26 Allowed 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.563 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 5.9 mtp -65.89 26.09 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 O-C-N 121.569 -0.707 . . . . 0.0 109.11 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.735 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.28 -8.97 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 106.64 -1.615 . . . . 0.0 106.64 -178.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.66 148.53 27.89 Favored 'General case' 0 C--N 1.306 -1.298 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -94.65 174.8 6.93 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.64 134.96 7.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.442 -1.303 . . . . 0.0 109.929 -178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.578 ' O ' ' N ' ' B' ' 571' ' ' GLU . 7.4 m80 -55.91 115.33 9.36 Favored Pre-proline 0 C--N 1.302 -1.473 0 N-CA-C 105.405 -2.072 . . . . 0.0 105.405 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.578 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 44.3 Cg_exo -45.75 -11.67 0.06 OUTLIER 'Trans proline' 0 C--N 1.309 -1.537 0 CA-C-N 120.317 1.149 . . . . 0.0 111.586 -178.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.74 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.2 mt-10 -98.3 -52.87 3.52 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-O 122.102 0.953 . . . . 0.0 110.077 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.48 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.1 m170 -57.04 -4.58 0.19 Allowed 'General case' 0 C--N 1.292 -1.901 0 O-C-N 120.633 -1.292 . . . . 0.0 109.715 -179.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.475 ' H ' ' C ' ' B' ' 571' ' ' GLU . 14.0 t80 -127.55 54.43 1.68 Allowed 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.74 HG13 ' O ' ' B' ' 571' ' ' GLU . 13.8 m -93.53 177.58 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 121.624 0.726 . . . . 0.0 110.147 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.659 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.88 141.42 32.24 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.369 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . 0.488 ' O ' ' CE1' ' B' ' 595' ' ' TYR . . . -90.52 76.41 6.6 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 116.719 -1.992 . . . . 0.0 108.801 178.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -153.1 -61.52 0.15 Allowed 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 102.498 -3.149 . . . . 0.0 102.498 174.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.55 ' O ' ' N ' ' B' ' 580' ' ' LYS . 20.8 p -120.16 81.57 1.76 Allowed 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 111.647 -2.524 . . . . 0.0 104.803 176.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 2.2 mt -53.02 15.48 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.55 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.53 -38.15 17.5 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 119.636 -1.915 . . . . 0.0 112.258 -178.547 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.578 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.8 tp60 -161.09 142.36 11.69 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 119.673 -1.892 . . . . 0.0 114.341 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.659 HD13 ' HB2' ' B' ' 575' ' ' CYS . 24.0 tp -134.06 171.02 14.79 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 175.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.442 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 74.0 m-20 -146.77 128.53 15.27 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.186 -0.947 . . . . 0.0 109.468 -179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.688 ' CE ' ' H ' ' B' ' 562' ' ' THR . 4.5 ptpp? -50.66 -19.41 0.92 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.622 -0.673 . . . . 0.0 110.014 179.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -85.51 -21.15 55.01 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.894 -1.683 . . . . 0.0 108.894 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -133.75 28.63 3.9 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -89.69 107.05 18.87 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-O 122.788 1.28 . . . . 0.0 110.288 -179.646 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.516 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -100.88 168.46 9.62 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 179.351 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 12.0 tt0 -152.4 157.22 40.93 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.795 -1.191 . . . . 0.0 110.673 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.598 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 1.2 tp-100 -154.15 145.83 23.31 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 106.87 -1.529 . . . . 0.0 106.87 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.551 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 45.68 23.9 0.17 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.03 -1.044 . . . . 0.0 109.872 -179.719 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.479 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.77 -4.85 1.54 Allowed 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.386 0.612 . . . . 0.0 110.482 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -88.59 121.19 70.24 Favored Pre-proline 0 C--N 1.294 -1.825 0 O-C-N 121.306 -0.871 . . . . 0.0 109.394 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.44 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 49.7 Cg_exo -48.84 164.64 0.22 Allowed 'Trans proline' 0 N--CA 1.489 1.22 0 CA-C-N 120.106 1.073 . . . . 0.0 111.782 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.516 ' O ' ' N ' ' B' ' 588' ' ' LYS . 7.4 m-85 -170.75 142.08 1.91 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.024 -1.048 . . . . 0.0 110.373 -178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 22.4 m -77.8 154.78 31.57 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.589 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -60.58 -58.3 9.07 Favored 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 179.113 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -46.17 -26.64 0.81 Allowed 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.675 -0.64 . . . . 0.0 109.484 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 54.4 m -85.0 -63.9 1.25 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.544 -0.722 . . . . 0.0 109.099 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -52.49 -53.85 40.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.519 -0.738 . . . . 0.0 109.355 -179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.635 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -49.59 -42.33 44.33 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.52 -24.73 14.19 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.364 -0.835 . . . . 0.0 109.559 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.8 mt -93.76 -57.21 2.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.251 -0.906 . . . . 0.0 111.685 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.598 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 4.6 m-85 -87.16 31.5 0.72 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.046 -1.034 . . . . 0.0 110.253 -178.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.943 -1.098 . . . . 0.0 109.447 179.253 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ttt . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 3' ' ' LEU . . . -151.27 -20.65 0.2 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.999 -1.063 . . . . 0.0 109.232 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' A' ' 5' ' ' GLY . 48.5 mt -38.63 -72.45 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 122.449 1.118 . . . . 0.0 109.801 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' CG ' ' O ' ' A' ' 4' ' ' ASP . 21.8 t70 45.26 19.26 0.04 OUTLIER 'General case' 0 C--N 1.289 -2.023 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.585 179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 3' ' ' LEU . . . -66.74 -10.61 55.5 Favored Glycine 0 N--CA 1.486 2.018 0 N-CA-C 108.21 -1.956 . . . . 0.0 108.21 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.607 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -108.33 -105.49 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.501 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -156.38 -96.85 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 O-C-N 120.376 -1.453 . . . . 0.0 110.597 -179.598 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.501 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -133.29 -53.48 0.03 OUTLIER Pre-proline 0 N--CA 1.509 2.522 0 O-C-N 120.882 -1.136 . . . . 0.0 112.065 -178.673 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -56.71 -34.9 97.12 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 CA-C-N 120.815 1.327 . . . . 0.0 110.094 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -111.43 -26.2 9.22 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.94 -3.02 88.18 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 8' ' ' MET . 0.7 OUTLIER -156.6 -28.85 0.09 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.94 -1.329 . . . . 0.0 110.371 -179.438 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.685 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 84.1 m-85 58.88 -94.41 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.685 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 164.49 -37.68 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.505 -0.747 . . . . 0.0 109.019 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -148.79 1.06 0.57 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.263 -0.898 . . . . 0.0 109.747 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.88 14.59 57.73 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.557 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -84.61 125.55 32.55 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.118 -1.225 . . . . 0.0 109.44 179.789 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.87 118.96 23.58 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.61 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -74.06 127.44 32.91 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.068 -1.053 . . . . 0.0 108.368 -179.769 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.493 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -82.82 134.02 35.12 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 179.568 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 t -76.78 145.66 38.38 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.414 ' N ' ' O ' ' A' ' 31' ' ' VAL . 14.3 t -137.57 105.85 3.87 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 CA-C-O 121.784 0.802 . . . . 0.0 110.036 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.499 ' NE2' ' OD1' ' A' ' 30' ' ' ASP . 23.7 m80 -82.5 103.53 12.11 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.532 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.0 t -73.72 120.18 22.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.498 ' O ' ' N ' ' A' ' 27' ' ' LEU . 2.3 p -80.35 -60.51 2.29 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.06 -1.025 . . . . 0.0 111.064 -177.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.435 ' N ' ' OG1' ' A' ' 25' ' ' THR . 14.0 t0 -50.04 -11.01 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.755 -1.215 . . . . 0.0 109.853 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 25' ' ' THR . 2.6 mt -119.13 -37.17 3.24 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 85.93 8.15 0.33 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 122.364 -0.21 . . . . 0.0 111.555 178.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.642 ' NH1' HD22 ' A' ' 52' ' ' LEU . 27.5 ptt180 -93.28 -175.75 3.92 Favored 'General case' 0 C--N 1.31 -1.112 0 O-C-N 120.487 -1.383 . . . . 0.0 109.236 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.499 ' OD1' ' NE2' ' A' ' 23' ' ' HIS . 20.6 m-20 -131.97 115.81 16.33 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.705 0.764 . . . . 0.0 109.125 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG12 ' N ' ' A' ' 32' ' ' THR . 35.7 t -109.21 157.2 9.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.426 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.5 131.84 40.31 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 107.861 -1.162 . . . . 0.0 107.861 179.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.426 HD22 ' C ' ' A' ' 32' ' ' THR . 2.1 mm? -113.8 113.08 24.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.617 -0.677 . . . . 0.0 109.291 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.557 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 10.7 tpt180 -60.03 104.17 0.28 Allowed 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.28 -169.54 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 122.119 0.961 . . . . 0.0 110.89 -178.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.414 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.4 p -144.93 172.42 13.06 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 107.173 -1.417 . . . . 0.0 107.173 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.16 43.48 2.25 Favored Glycine 0 N--CA 1.483 1.804 0 N-CA-C 108.921 -1.672 . . . . 0.0 108.921 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.48 ' C ' HG21 ' A' ' 78' ' ' THR . 0.3 OUTLIER -142.39 3.61 1.53 Allowed 'General case' 0 N--CA 1.486 1.327 0 O-C-N 121.608 -0.936 . . . . 0.0 108.785 179.815 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 78' ' ' THR . 2.9 m -90.45 133.4 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.142 -0.974 . . . . 0.0 110.142 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 43' ' ' GLY . 11.4 m-70 -76.24 144.2 40.51 Favored 'General case' 0 C--N 1.293 -1.867 0 O-C-N 120.814 -1.179 . . . . 0.0 108.579 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.457 ' C ' ' N ' ' A' ' 43' ' ' GLY . 82.5 mt -49.08 -51.53 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 120.992 -1.068 . . . . 0.0 109.101 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -53.55 -15.99 4.84 Favored Glycine 0 N--CA 1.484 1.847 0 N-CA-C 108.283 -1.927 . . . . 0.0 108.283 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.457 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -85.43 -25.85 38.06 Favored Glycine 0 N--CA 1.485 1.935 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.406 ' N ' ' O ' ' A' ' 41' ' ' ILE . 38.5 t -81.44 -50.1 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.527 -0.984 . . . . 0.0 109.35 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.418 ' HB2' ' NE2' ' A' ' 61' ' ' HIS . 0.0 OUTLIER -55.67 -41.0 73.04 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 120.806 -1.184 . . . . 0.0 108.419 179.406 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.59 HD12 HD13 ' B' ' 603' ' ' LEU . 5.8 tt -50.24 -58.56 5.34 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.239 -0.913 . . . . 0.0 109.174 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 48' ' ' LEU . 61.8 mttm -52.13 -54.54 29.36 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.468 -0.77 . . . . 0.0 110.561 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 48' ' ' LEU . 4.0 mm? -45.67 -61.89 1.52 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.547 -1.346 . . . . 0.0 108.822 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.626 ' O ' ' N ' ' A' ' 53' ' ' ASP . 97.4 t -52.69 -49.87 44.03 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.682 0 O-C-N 121.526 -0.733 . . . . 0.0 109.372 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -46.3 -40.61 11.97 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.714 -1.241 . . . . 0.0 109.711 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.425 ' NZ ' HD11 ' A' ' 33' ' ' LEU . 54.5 mttp -69.3 -57.63 5.06 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.322 -0.861 . . . . 0.0 110.325 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.642 HD22 ' NH1' ' A' ' 29' ' ' ARG . 16.2 tp -110.34 41.98 1.65 Allowed 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.475 1.131 . . . . 0.0 109.56 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.626 ' N ' ' O ' ' A' ' 49' ' ' VAL . 36.4 t0 -52.08 -84.92 0.01 OUTLIER 'General case' 0 C--N 1.263 -3.186 0 CA-C-O 122.232 1.015 . . . . 0.0 109.291 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 55' ' ' LYS . 14.1 p 43.14 179.24 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.277 -2.569 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.861 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.737 ' H ' HG22 ' A' ' 54' ' ' VAL . 0.7 OUTLIER -77.33 30.49 0.15 Allowed 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.643 -1.286 . . . . 0.0 108.208 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.621 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 36.7 tttm -79.57 137.42 37.15 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 119.081 -1.048 . . . . 0.0 109.033 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -50.95 112.44 0.71 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.567 -0.708 . . . . 0.0 110.126 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.621 ' CH2' ' NZ ' ' A' ' 56' ' ' LYS . 12.7 m95 -127.44 -21.34 3.85 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.708 0.766 . . . . 0.0 109.788 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.2 t -40.05 -52.79 2.48 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.2 -0.938 . . . . 0.0 111.369 -178.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.426 ' O ' ' O ' ' A' ' 94' ' ' PRO . 17.2 t0 -83.62 13.37 4.68 Favored 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.537 -0.727 . . . . 0.0 110.963 -178.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.62 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 3.6 p-80 -71.59 148.75 46.3 Favored 'General case' 0 C--N 1.294 -1.807 0 O-C-N 120.741 -1.224 . . . . 0.0 111.988 -178.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.98 155.22 5.5 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.661 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.8 mm? -93.93 148.46 22.13 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.532 ' NE1' ' OE1' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -127.25 151.52 48.61 Favored 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.333 -0.854 . . . . 0.0 108.913 -178.982 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.552 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.0 t90 -112.65 94.65 5.01 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.256 -0.903 . . . . 0.0 108.639 -179.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -55.77 -23.9 32.36 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.245 -0.909 . . . . 0.0 110.872 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.529 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -68.8 -9.03 48.69 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 178.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -133.56 -12.22 2.7 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 115.32 -0.855 . . . . 0.0 108.842 -178.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.1 mpp_? 52.43 45.77 27.91 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 107.154 -1.425 . . . . 0.0 107.154 -178.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 t -113.37 -173.35 2.24 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.673 0.749 . . . . 0.0 110.143 -178.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.32 101.64 7.06 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.721 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' LEU . 34.4 mt -61.74 86.06 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.292 0 O-C-N 120.433 -1.417 . . . . 0.0 110.892 -176.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.6 pp -119.47 8.74 11.39 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.529 ' C ' ' H ' ' A' ' 76' ' ' HIS . 9.5 mmpt? -74.93 58.53 0.85 Allowed 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.1 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.587 HG21 ' O ' ' B' ' 602' ' ' LYS . 0.9 OUTLIER -58.82 -5.95 0.69 Allowed 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 178.694 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -36.03 -63.44 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.883 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.417 ' HB3' ' H ' ' A' ' 78' ' ' THR . 1.2 t90 -130.78 -100.04 0.31 Allowed 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.222 -0.924 . . . . 0.0 111.221 -178.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -151.35 -164.38 1.98 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 119.671 -1.893 . . . . 0.0 111.365 -177.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.595 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.1 mp -68.8 -57.79 5.09 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -42.35 -46.7 4.7 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.499 ' HD2' ' H ' ' A' ' 78' ' ' THR . 0.0 OUTLIER -62.23 -28.93 70.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 -178.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.487 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -85.79 -47.4 9.76 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.418 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 113.59 21.71 5.68 Favored Glycine 0 N--CA 1.499 2.854 0 N-CA-C 108.088 -2.005 . . . . 0.0 108.088 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 36.4 mt -82.53 161.39 3.53 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.877 -0.778 . . . . 0.0 109.907 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -167.76 -163.4 0.49 Allowed 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.37 -27.12 62.18 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.435 -0.791 . . . . 0.0 109.598 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.71 -14.46 62.46 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.463 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.32 113.93 26.51 Favored 'General case' 0 C--N 1.298 -1.652 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.7 mmtp -94.67 118.85 32.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.015 -1.053 . . . . 0.0 109.577 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.493 ' HG ' HD12 ' A' ' 20' ' ' LEU . 9.4 mt -96.0 176.94 5.92 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.714 0.768 . . . . 0.0 109.675 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.532 ' OE1' ' NE1' ' A' ' 64' ' ' TRP . 10.0 mt-30 -131.13 165.56 23.02 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.111 -1.44 . . . . 0.0 107.111 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.54 ' CE2' ' CZ3' ' A' ' 58' ' ' TRP . 31.8 t80 -133.8 90.92 2.76 Favored 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.66 153.74 39.71 Favored Pre-proline 0 N--CA 1.499 1.987 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.663 -178.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 60' ' ' ASP . 65.4 Cg_endo . . . . . 0 N--CA 1.493 1.479 0 C-N-CA 122.471 2.114 . . . . 0.0 111.444 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -98.95 -63.38 1.13 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.337 -0.852 . . . . 0.0 109.715 -179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.45 ' O ' ' O ' ' B' ' 544' ' ' ARG . 4.8 pt-20 -90.18 -0.4 57.59 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.258 -0.901 . . . . 0.0 110.041 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.495 ' N ' ' CD ' ' B' ' 544' ' ' ARG . 0.1 OUTLIER 43.68 -169.39 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.309 -0.869 . . . . 0.0 110.305 179.534 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.475 ' N ' ' CD ' ' B' ' 545' ' ' ARG . 0.2 OUTLIER -69.02 -124.24 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.164 -0.96 . . . . 0.0 109.55 -179.805 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -168.12 -92.86 0.09 OUTLIER Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.849 -1.301 . . . . 0.0 109.849 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.552 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.1 m -169.18 120.06 0.72 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.29 -1.124 . . . . 0.0 108.225 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.84 135.21 57.71 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 120.774 -1.204 . . . . 0.0 110.39 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.484 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.72 103.82 13.32 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 178.247 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.5 t -50.8 127.05 17.42 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-O 122.14 0.972 . . . . 0.0 109.601 -177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.68 -34.56 5.4 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 106.043 -2.823 . . . . 0.0 106.043 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.6 m -106.04 -35.71 7.17 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.452 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.03 56.31 6.73 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-O 122.663 1.22 . . . . 0.0 109.968 -178.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -140.72 124.17 10.18 Favored Pre-proline 0 C--N 1.293 -1.855 0 N-CA-C 107.084 -1.45 . . . . 0.0 107.084 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -44.4 135.14 9.14 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 CA-C-N 120.452 1.197 . . . . 0.0 114.583 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.552 ' N ' ' O ' ' B' ' 547' ' ' SER . 39.8 mt -93.64 98.49 8.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.4 p -99.52 91.36 4.87 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.29 -0.881 . . . . 0.0 111.313 -177.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.63 -95.31 0.15 Allowed Glycine 0 N--CA 1.488 2.145 0 N-CA-C 107.455 -2.258 . . . . 0.0 107.455 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.478 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.2 mmt180 -114.28 151.66 32.55 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 178.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.8 p -144.56 126.3 15.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.964 -1.085 . . . . 0.0 111.556 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . 0.477 ' HA ' ' HZ2' ' B' ' 584' ' ' LYS . 46.8 mt -91.29 146.86 5.71 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.619 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.735 ' H ' ' NZ ' ' B' ' 584' ' ' LYS . 7.3 m -117.41 147.06 43.02 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-O 121.888 0.851 . . . . 0.0 109.336 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.745 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.29 -129.17 0.26 Allowed 'General case' 0 C--N 1.295 -1.789 0 CA-C-O 121.499 0.666 . . . . 0.0 109.383 -178.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.556 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 6.6 mtt -65.73 26.13 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.745 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.19 -9.03 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.89 163.56 22.17 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -106.1 174.25 5.97 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.14 138.11 9.96 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.33 -1.348 . . . . 0.0 109.813 -179.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.596 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.4 m80 -57.16 116.24 12.98 Favored Pre-proline 0 C--N 1.298 -1.646 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 177.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.565 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 52.7 Cg_exo -45.13 -10.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.31 -1.461 0 CA-C-N 120.311 1.147 . . . . 0.0 111.894 -178.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.922 ' O ' HG13 ' B' ' 574' ' ' VAL . 12.4 mt-10 -100.06 -52.42 3.42 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-O 122.018 0.913 . . . . 0.0 110.042 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.413 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.5 m170 -58.01 -4.25 0.31 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.864 -1.147 . . . . 0.0 109.81 -179.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' B' ' 571' ' ' GLU . 27.1 t80 -125.91 54.66 1.5 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.922 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.4 m -93.9 177.75 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 CA-C-O 121.925 0.869 . . . . 0.0 110.616 -178.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.634 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -82.29 143.6 31.19 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.626 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.47 74.76 3.29 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 116.672 -2.011 . . . . 0.0 109.84 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . 0.593 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 0.3 OUTLIER -153.65 -48.31 0.09 Allowed 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 102.047 -3.316 . . . . 0.0 102.047 173.244 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.544 ' SG ' ' O ' ' B' ' 578' ' ' CYS . 29.5 p -132.0 81.52 1.97 Allowed 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 176.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 1.8 mt -53.1 15.65 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.907 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.536 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.47 -37.38 18.34 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 119.686 -1.884 . . . . 0.0 112.628 -178.255 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.565 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -160.3 140.72 11.69 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 119.596 -1.94 . . . . 0.0 114.448 178.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.634 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.6 tp -137.77 169.82 17.13 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 70.5 m-20 -146.22 133.58 20.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.27 -0.894 . . . . 0.0 109.429 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.735 ' NZ ' ' H ' ' B' ' 562' ' ' THR . 2.7 ptpp? -55.38 -14.4 1.89 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.703 0.763 . . . . 0.0 109.518 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -92.9 -16.08 49.61 Favored Glycine 0 N--CA 1.485 1.953 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -137.31 28.58 2.77 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.572 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 3.7 p90 -89.17 111.71 22.55 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-O 122.304 1.05 . . . . 0.0 109.814 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.56 167.12 10.0 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.873 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.439 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 13.6 tt0 -152.84 157.56 40.9 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.665 -1.272 . . . . 0.0 110.855 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.543 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.3 tp-100 -159.25 146.53 17.18 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 106.214 -1.773 . . . . 0.0 106.214 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.615 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.1 22.62 0.43 Allowed 'General case' 0 C--N 1.296 -1.726 0 O-C-N 120.954 -1.091 . . . . 0.0 109.505 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.472 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 80.72 -5.75 1.7 Allowed 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.718 -0.614 . . . . 0.0 110.849 178.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . 0.475 ' O ' ' CD1' ' B' ' 595' ' ' TYR . 31.8 mttm -90.5 116.86 67.34 Favored Pre-proline 0 C--N 1.294 -1.824 0 O-C-N 121.22 -0.925 . . . . 0.0 109.483 -179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.527 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 36.0 Cg_exo -49.52 165.9 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.303 0 CA-C-N 120.026 1.045 . . . . 0.0 112.13 179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.527 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 42.2 m-85 -170.13 138.68 1.7 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.24 -0.912 . . . . 0.0 109.776 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 15.3 m -69.57 152.84 44.3 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.343 -2.466 . . . . 0.0 104.343 174.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.54 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -57.0 -56.9 15.78 Favored 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 179.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -45.85 -30.61 1.76 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.462 -0.773 . . . . 0.0 109.731 179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . 0.593 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 81.0 m -81.23 -60.96 2.09 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.262 -0.898 . . . . 0.0 108.806 179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.583 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -57.42 -53.63 55.96 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 121.124 0.488 . . . . 0.0 110.187 -179.595 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.71 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -49.83 -43.47 48.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 120.981 -1.074 . . . . 0.0 109.108 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.587 ' O ' HG21 ' A' ' 75' ' ' THR . 60.0 tttt -55.77 -21.06 17.15 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.104 -0.997 . . . . 0.0 109.46 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.59 HD13 HD12 ' A' ' 46' ' ' LEU . 4.8 mt -91.92 -56.75 2.97 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.28 -0.887 . . . . 0.0 110.194 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -98.85 30.25 3.43 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.192 -0.943 . . . . 0.0 109.438 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.493 1.69 0 O-C-N 120.836 -1.165 . . . . 0.0 109.224 179.603 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.412 ' SD ' HD13 ' A' ' 3' ' ' LEU . 35.9 ttm . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.76 -35.37 0.38 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.943 -1.098 . . . . 0.0 108.86 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.926 ' H ' HD12 ' A' ' 3' ' ' LEU . 5.6 mp -59.57 -63.6 1.24 Allowed 'General case' 0 C--N 1.299 -1.587 0 CA-C-O 121.901 0.858 . . . . 0.0 109.248 179.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' C ' HD13 ' A' ' 6' ' ' ILE . 23.2 t0 -91.41 27.47 1.95 Allowed 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.522 ' O ' ' C ' ' A' ' 6' ' ' ILE . . . -118.55 -10.09 8.84 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.041 -1.624 . . . . 0.0 109.041 -178.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.522 ' C ' ' O ' ' A' ' 5' ' ' GLY . 0.0 OUTLIER -4.28 -85.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.288 -2.102 0 CA-C-N 113.762 -1.219 . . . . 0.0 112.619 177.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.638 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -166.21 -108.6 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.859 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.345 -179.113 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.638 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -154.1 -62.44 0.02 OUTLIER Pre-proline 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.574 -177.011 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -43.15 -44.33 9.82 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 121.208 1.467 . . . . 0.0 110.957 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.415 ' HB3' ' HE ' ' A' ' 7' ' ' ARG . 7.9 t70 -103.8 -20.94 13.76 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.05 -6.56 86.46 Favored Glycine 0 N--CA 1.484 1.848 0 N-CA-C 109.574 -1.411 . . . . 0.0 109.574 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 8' ' ' MET . 11.5 t -168.92 -72.77 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.513 -0.992 . . . . 0.0 110.109 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -164.8 -48.41 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.242 -0.911 . . . . 0.0 109.614 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -161.88 -45.87 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.385 -0.822 . . . . 0.0 109.643 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -149.94 5.49 0.58 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.259 -0.901 . . . . 0.0 109.981 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.551 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 106.53 23.25 7.31 Favored Glycine 0 N--CA 1.497 2.715 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.684 ' CG2' ' HE ' ' A' ' 34' ' ' ARG . 39.3 p -79.93 130.02 34.96 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.318 -1.107 . . . . 0.0 109.511 -179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.551 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -148.81 126.09 11.5 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.857 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -81.27 130.21 34.93 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.979 -1.076 . . . . 0.0 109.895 -179.68 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.73 HD11 ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.47 133.03 34.49 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 179.343 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.46 142.67 39.04 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.017 -1.052 . . . . 0.0 108.595 -179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 90' ' ' LEU . 24.8 t -136.25 109.93 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 CA-C-O 121.965 0.888 . . . . 0.0 109.992 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CG ' ' OD2' ' A' ' 30' ' ' ASP . 9.4 m-70 -85.72 103.84 14.88 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 179.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.8 t -72.53 109.95 5.2 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.643 -1.223 . . . . 0.0 107.796 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.462 ' C ' ' H ' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -80.38 -39.29 28.69 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.166 -0.959 . . . . 0.0 109.588 -178.86 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 8.7 t0 -67.65 3.15 1.5 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.151 -0.968 . . . . 0.0 108.89 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.472 ' O ' ' CB ' ' A' ' 28' ' ' ASN . 2.3 mt -139.63 -28.6 0.76 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.492 -0.755 . . . . 0.0 109.093 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.542 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 82.55 12.88 0.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 122.124 -0.36 . . . . 0.0 110.432 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.4 mtp-105 -94.87 -178.27 4.45 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.854 -1.154 . . . . 0.0 109.72 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CG ' ' A' ' 23' ' ' HIS . 40.7 m-20 -138.38 115.98 11.35 Favored 'General case' 0 C--N 1.294 -1.831 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.415 HG12 ' N ' ' A' ' 32' ' ' THR . 18.5 t -117.16 157.69 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 CA-C-O 121.666 0.746 . . . . 0.0 110.145 -179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.451 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.18 130.32 38.99 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.451 HD22 ' O ' ' A' ' 32' ' ' THR . 2.9 mm? -116.73 115.88 26.47 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.17 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.684 ' HE ' ' CG2' ' A' ' 17' ' ' THR . 0.0 OUTLIER -61.37 138.48 58.25 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 34' ' ' ARG . 11.5 m -160.33 -169.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.28 -2.438 0 CA-C-O 121.788 0.804 . . . . 0.0 109.241 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.475 ' C ' ' H ' ' A' ' 38' ' ' GLU . 2.7 p -145.18 165.13 29.23 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 178.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -74.16 43.93 1.3 Allowed Glycine 0 C--N 1.292 -1.887 0 N-CA-C 108.839 -1.704 . . . . 0.0 108.839 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.499 ' HA ' HG21 ' A' ' 78' ' ' THR . 0.8 OUTLIER -144.27 3.99 1.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.684 -0.892 . . . . 0.0 108.943 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.674 ' O ' HG22 ' A' ' 78' ' ' THR . 3.0 m -90.12 149.51 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.116 -0.99 . . . . 0.0 110.05 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -85.31 142.48 29.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.829 -1.17 . . . . 0.0 108.045 178.791 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 94.3 mt -47.77 -54.9 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 O-C-N 121.081 -1.012 . . . . 0.0 109.041 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.541 ' H ' HG23 ' A' ' 75' ' ' THR . . . -55.2 -17.04 10.03 Favored Glycine 0 N--CA 1.484 1.882 0 N-CA-C 108.224 -1.95 . . . . 0.0 108.224 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -70.84 -29.31 69.45 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 108.319 -1.912 . . . . 0.0 108.319 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.26 -36.36 12.69 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.442 ' HE2' ' HZ3' ' B' ' 602' ' ' LYS . 33.1 mtm -51.29 -37.02 45.21 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.74 -1.207 . . . . 0.0 107.74 178.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.7 tp -69.89 -65.95 0.65 Allowed 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.461 0.648 . . . . 0.0 110.66 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.9 mtmm -53.81 -55.7 24.17 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.41 -0.806 . . . . 0.0 111.467 -178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.412 HD21 ' CD1' ' A' ' 92' ' ' PHE . 62.2 tp -45.98 -48.67 16.5 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.875 -1.14 . . . . 0.0 109.958 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 49.9 t -67.8 -46.1 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 120.972 -1.08 . . . . 0.0 109.633 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -45.28 -38.43 5.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.284 -0.885 . . . . 0.0 109.56 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -66.59 -44.69 81.48 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.369 -0.832 . . . . 0.0 109.992 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -60.13 -65.18 0.72 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.011 -1.056 . . . . 0.0 108.361 179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.456 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.5 t70 76.44 80.83 0.09 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.964 0.887 . . . . 0.0 110.561 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.494 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.32 140.38 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.048 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.633 ' HZ2' HD12 ' B' ' 579' ' ' LEU . 1.8 tptp -69.18 35.67 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.376 -0.827 . . . . 0.0 109.946 -179.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 54' ' ' VAL . 11.6 ttmm -78.44 147.12 34.12 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.989 -1.07 . . . . 0.0 109.024 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.522 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 0.9 OUTLIER -61.86 107.03 0.77 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.537 -0.727 . . . . 0.0 109.377 179.805 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.511 ' O ' ' N ' ' A' ' 61' ' ' HIS . 75.8 m95 -106.42 -35.12 7.2 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.373 -0.83 . . . . 0.0 110.224 -179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.405 ' C ' ' O ' ' A' ' 58' ' ' TRP . 1.5 t -41.57 -51.21 3.99 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.457 -0.777 . . . . 0.0 109.826 -179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -56.6 -37.73 71.06 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.522 ' CD2' ' O ' ' A' ' 57' ' ' ASP . 11.1 m-70 -72.64 134.79 45.28 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-O 121.649 0.738 . . . . 0.0 109.849 179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -145.95 174.83 10.92 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.766 HD22 ' N ' ' A' ' 63' ' ' LEU . 2.1 mm? -94.54 141.02 29.08 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.885 -1.134 . . . . 0.0 109.978 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.497 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -125.32 151.12 46.46 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.674 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.541 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -111.03 93.64 4.58 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.041 -1.037 . . . . 0.0 108.652 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.72 -24.21 21.11 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.179 -0.951 . . . . 0.0 111.043 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.533 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 20.0 mmtp -67.97 -9.44 45.43 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.4 mmtt -133.78 -12.53 2.61 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.955 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.8 mpp_? 52.49 45.74 28.0 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 -178.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.0 t -112.13 -171.49 1.86 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-O 121.393 0.616 . . . . 0.0 109.697 -178.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.544 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -127.89 99.14 5.4 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 177.147 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -60.3 83.94 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 CA-C-O 122.594 1.188 . . . . 0.0 110.608 -176.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.4 pp -118.97 6.97 11.36 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.916 -1.512 . . . . 0.0 106.916 178.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.508 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -83.63 57.31 4.01 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.594 HG21 ' O ' ' B' ' 602' ' ' LYS . 5.4 m -49.71 -11.65 0.06 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.056 -1.028 . . . . 0.0 109.126 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.508 ' N ' ' O ' ' A' ' 74' ' ' LYS . 41.1 m80 -64.45 150.06 47.28 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.404 -0.81 . . . . 0.0 109.786 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 78.8 m95 54.98 -129.26 2.16 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.756 -0.59 . . . . 0.0 110.319 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.674 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -156.24 -163.66 1.51 Allowed 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 118.262 -1.375 . . . . 0.0 112.886 -177.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.595 ' N ' HD12 ' A' ' 79' ' ' LEU . 6.3 mp -69.03 -56.06 8.92 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -44.82 -46.29 10.6 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.731 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -58.3 -31.24 67.31 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -178.768 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.519 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -85.11 -46.23 11.32 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 117.13 14.32 7.19 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 108.631 -1.787 . . . . 0.0 108.631 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.538 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 35.8 mt -72.61 161.53 4.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 121.726 -0.867 . . . . 0.0 109.902 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.38 -171.97 1.18 Allowed 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.61 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.45 -20.02 65.44 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.327 -0.858 . . . . 0.0 109.993 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.506 ' OD2' ' N ' ' A' ' 88' ' ' ALA . 46.0 p-10 -79.92 -21.0 44.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.73 ' O ' HD11 ' A' ' 20' ' ' LEU . . . -103.47 112.39 25.27 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 179.07 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.893 ' O ' HD23 ' A' ' 90' ' ' LEU . 4.6 ptpp? -98.41 174.5 6.44 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.035 -1.04 . . . . 0.0 110.317 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.893 HD23 ' O ' ' A' ' 89' ' ' LYS . 2.3 mt -138.13 179.69 6.3 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 121.913 0.863 . . . . 0.0 109.368 -178.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.482 ' CD ' ' NE1' ' A' ' 64' ' ' TRP . 5.3 mt-30 -129.81 168.55 16.39 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 105.815 -1.92 . . . . 0.0 105.815 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.412 ' CD1' HD21 ' A' ' 48' ' ' LEU . 14.6 t80 -131.39 99.5 4.85 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.91 155.4 30.26 Favored Pre-proline 0 N--CA 1.494 1.753 0 C-N-CA 120.182 -0.607 . . . . 0.0 110.729 -176.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo . . . . . 0 N--CA 1.49 1.305 0 C-N-CA 123.255 2.636 . . . . 0.0 112.744 178.51 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -75.9 -83.3 0.07 Allowed 'General case' 0 C--N 1.306 -1.321 0 O-C-N 121.245 -0.909 . . . . 0.0 109.641 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.417 ' O ' ' C ' ' B' ' 544' ' ' ARG . 8.1 pt-20 -134.19 1.48 3.22 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.515 -0.741 . . . . 0.0 109.536 -179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.633 ' CD ' ' H ' ' B' ' 544' ' ' ARG . 0.4 OUTLIER -38.4 136.34 0.68 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.744 -0.598 . . . . 0.0 110.406 -179.555 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' B' ' 546' ' ' GLY . 0.0 OUTLIER -115.03 -51.27 2.73 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.605 -0.684 . . . . 0.0 110.566 -178.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . 0.43 ' O ' ' O ' ' B' ' 545' ' ' ARG . . . -56.39 -116.52 0.01 OUTLIER Glycine 0 N--CA 1.491 2.338 0 O-C-N 121.38 -0.825 . . . . 0.0 111.532 -178.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.618 ' H ' ' H ' ' B' ' 556' ' ' ILE . 2.4 m -168.92 120.35 0.76 Allowed 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 -178.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.8 mp -56.35 134.97 53.97 Favored 'General case' 0 C--N 1.295 -1.79 0 O-C-N 120.818 -1.176 . . . . 0.0 111.042 -177.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.554 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.61 104.26 14.44 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 178.093 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 4.3 t -49.38 126.08 12.41 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-O 122.139 0.971 . . . . 0.0 109.89 -178.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.18 -35.95 4.63 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 106.381 -2.688 . . . . 0.0 106.381 -177.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 9.8 m -103.53 -35.99 8.12 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 178.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.453 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.2 mm-40 55.25 56.07 6.83 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.819 1.295 . . . . 0.0 109.861 -178.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -140.94 124.1 9.93 Favored Pre-proline 0 C--N 1.294 -1.817 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -43.57 134.73 7.07 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 CA-C-N 120.461 1.2 . . . . 0.0 114.956 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.618 ' H ' ' H ' ' B' ' 547' ' ' SER . 41.2 mt -92.88 98.3 8.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 7.4 p -98.48 92.54 5.7 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.196 -0.94 . . . . 0.0 111.398 -177.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.56 -96.26 0.16 Allowed Glycine 0 N--CA 1.488 2.112 0 N-CA-C 107.421 -2.271 . . . . 0.0 107.421 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.467 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 7.2 mmt180 -114.88 153.09 31.12 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 177.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.0 p -144.49 126.79 15.77 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.923 -1.111 . . . . 0.0 111.373 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 50.3 mt -90.38 146.05 6.67 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.41 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 10.1 m -121.71 146.28 47.18 Favored 'General case' 0 C--N 1.29 -1.996 0 CA-C-O 122.008 0.908 . . . . 0.0 109.018 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.712 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.27 -128.73 0.27 Allowed 'General case' 0 C--N 1.291 -1.952 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.546 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 2.6 mtt -66.0 26.19 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.531 -0.731 . . . . 0.0 109.081 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.712 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.08 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 106.63 -1.619 . . . . 0.0 106.63 -178.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.46 147.78 28.53 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.4 mmmt -94.46 174.59 7.05 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.212 -0.93 . . . . 0.0 108.556 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -160.9 136.49 7.99 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.767 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.579 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -56.84 116.29 12.78 Favored Pre-proline 0 C--N 1.3 -1.575 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.552 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 39.1 Cg_exo -46.67 -10.2 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.471 0 CA-C-N 120.359 1.164 . . . . 0.0 111.399 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.918 ' O ' HG13 ' B' ' 574' ' ' VAL . 14.0 mt-10 -98.07 -52.08 3.82 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 122.019 0.914 . . . . 0.0 110.066 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.443 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 20.4 m170 -58.64 -4.17 0.39 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 120.949 -1.094 . . . . 0.0 109.764 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.437 ' H ' ' C ' ' B' ' 571' ' ' GLU . 17.0 t80 -128.09 58.45 1.52 Allowed 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.918 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.7 m -94.31 177.45 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-O 121.709 0.766 . . . . 0.0 111.359 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.589 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -77.48 147.36 35.92 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 179.07 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -94.84 74.35 3.58 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 116.595 -2.042 . . . . 0.0 110.033 179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -154.14 -65.61 0.14 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 102.436 -3.172 . . . . 0.0 102.436 172.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 25.4 p -111.04 82.06 1.53 Allowed 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 112.296 -2.229 . . . . 0.0 105.238 177.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 0.846 HD22 ' N ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -53.0 15.4 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 -176.677 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -88.5 -36.66 16.3 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 119.595 -1.941 . . . . 0.0 113.016 -178.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.552 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.4 tp60 -159.76 139.8 11.7 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 119.359 -2.088 . . . . 0.0 115.179 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.1 tp -139.53 168.7 19.22 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' B' ' 587' ' ' PHE . 59.2 m-20 -150.2 133.53 16.41 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.156 -0.965 . . . . 0.0 109.264 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.41 ' HE3' ' H ' ' B' ' 562' ' ' THR . 9.0 ptpt -51.3 -18.11 0.89 Allowed 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.482 -0.761 . . . . 0.0 109.432 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -19.32 53.11 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 -179.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . 0.404 ' N ' ' O ' ' B' ' 583' ' ' ASN . 1.7 p -134.31 25.58 3.82 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.559 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.5 OUTLIER -90.6 109.87 21.02 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 122.339 1.066 . . . . 0.0 109.897 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.462 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -103.18 159.28 15.68 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 179.647 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.435 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.6 tt0 -154.39 156.94 37.77 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 122.624 1.202 . . . . 0.0 111.147 -178.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.438 ' C ' ' ND2' ' B' ' 591' ' ' ASN . 2.4 pt20 -157.25 145.79 19.57 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 177.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.677 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.47 23.82 0.65 Allowed 'General case' 0 C--N 1.289 -2.033 0 O-C-N 121.318 -0.864 . . . . 0.0 109.277 -178.525 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 1.5 m-20 83.41 -7.91 1.12 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.915 -0.491 . . . . 0.0 111.958 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 26.3 mttm -85.72 115.82 63.16 Favored Pre-proline 0 C--N 1.296 -1.738 0 O-C-N 120.966 -1.084 . . . . 0.0 110.763 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.532 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 29.1 Cg_exo -53.99 161.92 4.45 Favored 'Trans proline' 0 N--CA 1.492 1.395 0 CA-C-N 120.018 1.042 . . . . 0.0 112.436 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.532 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.2 m-85 -171.47 141.68 1.56 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.473 -0.767 . . . . 0.0 109.621 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 7.0 m -71.21 154.58 41.56 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 104.434 -2.432 . . . . 0.0 104.434 174.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.589 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.03 -55.32 36.48 Favored 'General case' 0 C--N 1.292 -1.905 0 N-CA-C 106.071 -1.825 . . . . 0.0 106.071 179.191 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -46.76 -27.89 1.35 Allowed 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.648 -0.657 . . . . 0.0 109.47 179.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 52.4 m -85.27 -56.99 3.26 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 2.3 t80 -57.93 -54.23 49.32 Favored 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.676 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -51.06 -39.58 56.33 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.215 -0.928 . . . . 0.0 108.549 -179.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.594 ' O ' HG21 ' A' ' 75' ' ' THR . 0.7 OUTLIER -54.69 -30.75 56.59 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.533 -0.73 . . . . 0.0 110.036 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.45 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.2 OUTLIER -94.36 -57.48 2.49 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.246 -0.909 . . . . 0.0 111.761 -177.035 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.507 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 5.7 m-85 -88.81 24.58 2.0 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.106 -0.996 . . . . 0.0 110.517 -178.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.507 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 2.3 m . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 118.002 -0.999 . . . . 0.0 109.029 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ttm . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.95 -57.79 0.31 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.96 -1.088 . . . . 0.0 108.476 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.425 ' C ' ' N ' ' A' ' 5' ' ' GLY . 77.7 mt -49.03 -87.57 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 121.947 0.88 . . . . 0.0 109.263 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 20.4 t70 43.98 25.36 0.1 Allowed 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.863 0.84 . . . . 0.0 109.211 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.425 ' N ' ' C ' ' A' ' 3' ' ' LEU . . . -65.27 -14.77 60.05 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.13 -1.988 . . . . 0.0 108.13 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.696 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -111.16 -105.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.281 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.515 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -155.38 -99.05 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.274 0 O-C-N 120.531 -1.356 . . . . 0.0 109.883 -179.581 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.515 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -142.94 -61.56 0.02 OUTLIER Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 120.971 -1.081 . . . . 0.0 110.3 -179.429 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.4 ' C ' ' O ' ' A' ' 8' ' ' MET . 60.3 Cg_exo -43.14 -31.85 2.72 Favored 'Trans proline' 0 N--CA 1.492 1.419 0 CA-C-N 120.941 1.372 . . . . 0.0 109.889 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -117.31 -26.3 6.77 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.704 -1.135 . . . . 0.0 108.057 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -80.96 5.42 66.01 Favored Glycine 0 N--CA 1.486 2.006 0 N-CA-C 109.209 -1.557 . . . . 0.0 109.209 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.5 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 9.0 t -171.39 -47.43 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.43 -1.041 . . . . 0.0 109.692 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 2.3 t80 82.48 -40.7 0.11 Allowed 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 -179.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.673 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 162.34 -40.14 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -161.68 3.21 0.06 Allowed 'General case' 0 C--N 1.3 -1.579 0 C-N-CA 119.768 -0.773 . . . . 0.0 110.274 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.443 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 79.86 38.79 18.73 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 108.533 -1.827 . . . . 0.0 108.533 -179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.1 p -79.19 122.63 26.52 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.622 -0.928 . . . . 0.0 110.218 -179.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.443 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -132.85 122.25 24.14 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.624 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -75.66 134.72 40.51 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.498 -179.275 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.708 HD21 HG22 ' A' ' 84' ' ' ILE . 0.1 OUTLIER -83.66 131.24 34.96 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 179.244 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -77.57 145.45 36.85 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.069 -1.019 . . . . 0.0 108.589 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.0 t -139.58 130.63 32.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 120.014 -0.674 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.445 ' CD2' ' OD1' ' A' ' 30' ' ' ASP . 43.5 m80 -105.76 103.99 13.61 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 178.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.52 ' O ' ' N ' ' A' ' 28' ' ' ASN . 3.1 t -75.06 115.51 16.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 C-N-CA 118.514 -1.274 . . . . 0.0 108.668 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.37 -43.02 21.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.323 -0.861 . . . . 0.0 110.227 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD2' ' N ' ' A' ' 26' ' ' ASP . 3.2 p-10 -64.26 -11.33 30.46 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 120.929 -1.107 . . . . 0.0 109.48 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 27' ' ' LEU . 3.6 mm? -122.6 -24.16 4.98 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.542 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.3 OUTLIER 73.03 13.29 4.9 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 -177.638 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.3 mtp180 -89.02 -177.11 5.38 Favored 'General case' 0 C--N 1.307 -1.264 0 O-C-N 121.195 -0.941 . . . . 0.0 109.455 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.445 ' OD1' ' CD2' ' A' ' 23' ' ' HIS . 0.8 OUTLIER -138.45 118.46 13.39 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 178.022 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 20.3 t -118.41 155.93 20.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.716 0.77 . . . . 0.0 110.486 -178.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.425 ' O ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.66 131.12 39.16 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.111 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.447 HD11 ' HZ3' ' A' ' 51' ' ' LYS . 1.8 mm? -114.78 112.94 23.57 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.53 -0.732 . . . . 0.0 109.981 -178.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -60.98 104.99 0.42 Allowed 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.5 m -136.0 -169.12 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 CA-C-O 121.857 0.837 . . . . 0.0 110.099 -178.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.1 p -142.62 171.16 14.43 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.25 47.1 2.86 Favored Glycine 0 N--CA 1.482 1.735 0 N-CA-C 108.585 -1.806 . . . . 0.0 108.585 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -146.04 0.25 0.82 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.687 -0.89 . . . . 0.0 108.955 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.569 ' O ' HG22 ' A' ' 78' ' ' THR . 1.6 m -90.2 145.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.179 -0.951 . . . . 0.0 109.447 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.534 ' ND1' ' N ' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -78.91 133.65 36.92 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 177.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.68 -36.45 29.03 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 O-C-N 120.546 -1.347 . . . . 0.0 108.022 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -58.09 -22.37 49.06 Favored Glycine 0 N--CA 1.484 1.861 0 N-CA-C 107.185 -2.366 . . . . 0.0 107.185 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.42 -22.94 78.68 Favored Glycine 0 C--O 1.209 -1.463 0 N-CA-C 108.016 -2.033 . . . . 0.0 108.016 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.0 t -83.19 -33.85 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 61' ' ' HIS . 32.6 mtm -51.97 -39.19 58.93 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.666 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -77.11 -59.97 2.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.746 -0.596 . . . . 0.0 111.457 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -46.37 -56.06 6.42 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.812 -1.18 . . . . 0.0 110.112 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mt -46.52 -60.94 2.05 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.02 -1.05 . . . . 0.0 109.76 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 53.1 t -53.25 -47.78 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 120.969 -1.082 . . . . 0.0 110.056 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -45.51 -42.98 11.36 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.133 -0.979 . . . . 0.0 109.816 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.447 ' HZ3' HD11 ' A' ' 33' ' ' LEU . 55.0 mttp -62.94 -43.02 99.93 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.374 -0.829 . . . . 0.0 110.162 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.441 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.2 OUTLIER -62.0 -66.72 0.5 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.515 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.87 82.57 0.1 Allowed 'General case' 0 N--CA 1.488 1.435 0 CA-C-O 121.994 0.902 . . . . 0.0 110.119 178.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.513 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.2 p -171.41 141.56 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.058 0 C-N-CA 119.862 -0.735 . . . . 0.0 109.571 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -67.43 32.68 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.427 -0.795 . . . . 0.0 109.671 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.614 ' NZ ' ' CH2' ' A' ' 58' ' ' TRP . 20.1 ttpp -78.76 139.71 38.38 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.849 -1.157 . . . . 0.0 109.552 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -49.96 118.42 2.89 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.381 -0.824 . . . . 0.0 109.352 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.63 ' O ' ' CG ' ' A' ' 61' ' ' HIS . 61.2 m95 -118.94 -23.62 6.85 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.484 -0.76 . . . . 0.0 110.431 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.419 ' C ' ' H ' ' A' ' 61' ' ' HIS . 0.3 OUTLIER -44.85 -54.35 6.51 Favored 'General case' 0 C--N 1.29 -1.994 0 O-C-N 120.678 -1.264 . . . . 0.0 110.122 -179.206 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 49.0 t0 -59.8 -2.96 0.44 Allowed 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.436 -0.79 . . . . 0.0 110.076 -179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.63 ' CG ' ' O ' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -75.12 149.53 39.05 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 -179.446 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.4 ' C ' HD22 ' A' ' 63' ' ' LEU . . . -171.32 151.16 3.04 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -94.65 144.6 25.48 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.49 ' CD1' ' NE2' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.7 143.01 50.84 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.544 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -103.96 91.01 3.79 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.054 -1.029 . . . . 0.0 108.668 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.43 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.5 pt-20 -54.62 -22.62 14.04 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.227 -0.92 . . . . 0.0 111.205 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.46 ' HB2' ' NE1' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -64.43 -21.77 66.75 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 178.312 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.541 ' C ' HH21 ' A' ' 69' ' ' ARG . 15.3 mmtt -120.67 -12.09 8.93 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.38 -178.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.544 ' N ' ' O ' ' A' ' 65' ' ' TRP . 0.0 OUTLIER 52.9 46.53 26.59 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.006 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.58 -174.14 2.41 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.409 0.623 . . . . 0.0 110.125 -178.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.527 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.57 98.39 5.01 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 177.385 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.18 92.31 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.018 0 CA-C-O 123.04 1.4 . . . . 0.0 110.121 -176.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.3 pp -125.71 6.21 7.46 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 114.209 -1.36 . . . . 0.0 108.006 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.524 ' O ' ' N ' ' A' ' 76' ' ' HIS . 0.0 OUTLIER -82.59 39.83 0.63 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.463 HG21 ' HD2' ' B' ' 602' ' ' LYS . 13.9 p -46.26 -15.11 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.078 -1.014 . . . . 0.0 110.127 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.524 ' N ' ' O ' ' A' ' 74' ' ' LYS . 7.9 m80 -79.27 43.42 0.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.154 -0.966 . . . . 0.0 110.253 -179.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -176.86 -142.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.025 -1.047 . . . . 0.0 108.573 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.569 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -152.58 166.34 32.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 119.736 -1.853 . . . . 0.0 111.261 -178.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.529 ' H ' ' CD1' ' A' ' 79' ' ' LEU . 6.5 mp -44.76 -59.02 2.72 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -45.64 -36.85 5.13 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.157 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.539 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -62.85 -35.71 80.86 Favored 'General case' 0 C--N 1.299 -1.602 0 C-N-CA 119.031 -1.068 . . . . 0.0 108.573 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.539 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -92.71 -38.84 11.6 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.016 -1.053 . . . . 0.0 108.426 178.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 116.85 12.63 8.38 Favored Glycine 0 N--CA 1.5 2.912 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.708 HG22 HD21 ' A' ' 20' ' ' LEU . 68.1 mt -61.04 156.61 3.39 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 121.433 -1.04 . . . . 0.0 108.519 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.545 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.77 -174.81 1.66 Allowed 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -179.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.74 -25.13 66.25 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.374 -0.829 . . . . 0.0 109.803 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -81.14 -6.08 58.42 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.36 112.82 24.92 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.691 -0.631 . . . . 0.0 109.451 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.0 mmtp -97.66 116.25 29.51 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.117 -0.989 . . . . 0.0 109.255 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.6 mt -99.62 177.81 5.04 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.627 0.727 . . . . 0.0 109.698 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.49 ' NE2' ' CD1' ' A' ' 64' ' ' TRP . 7.6 mt-30 -129.84 167.02 18.78 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -133.49 95.62 3.54 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.22 157.03 79.23 Favored Pre-proline 0 N--CA 1.503 2.217 0 O-C-N 121.944 -0.472 . . . . 0.0 111.275 -176.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo . . . . . 0 N--CA 1.497 1.73 0 C-N-CA 122.969 2.446 . . . . 0.0 111.758 178.74 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -71.53 -100.69 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.234 -0.916 . . . . 0.0 109.667 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.519 ' O ' ' O ' ' B' ' 544' ' ' ARG . 5.3 pt-20 -143.82 -4.14 0.86 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.238 -0.914 . . . . 0.0 110.153 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.519 ' O ' ' O ' ' B' ' 543' ' ' GLU . 0.2 OUTLIER 52.87 120.99 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.812 0.815 . . . . 0.0 110.808 179.281 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.42 ' H ' ' HG2' ' B' ' 545' ' ' ARG . 22.0 mmt180 -45.64 -93.4 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.967 -1.083 . . . . 0.0 109.909 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -157.56 -105.71 0.22 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.524 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.6 m -159.27 116.6 2.72 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.0 mp -61.36 135.82 57.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.021 -1.049 . . . . 0.0 110.346 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.504 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.32 103.51 12.76 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.874 -1.898 . . . . 0.0 105.874 178.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 14.7 t -50.8 126.54 16.12 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-O 122.144 0.974 . . . . 0.0 109.527 -177.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.9 -34.12 5.63 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 106.301 -2.719 . . . . 0.0 106.301 -177.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 7.1 m -106.45 -35.44 7.1 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.446 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 19.0 mm-40 55.28 56.63 6.21 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 122.659 1.219 . . . . 0.0 109.972 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -140.6 123.55 9.99 Favored Pre-proline 0 C--N 1.294 -1.845 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -44.41 135.81 8.86 Favored 'Trans proline' 0 N--CA 1.494 1.502 0 CA-C-N 120.509 1.217 . . . . 0.0 114.58 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.524 ' N ' ' O ' ' B' ' 547' ' ' SER . 40.0 mt -95.19 98.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 6.8 p -100.91 91.26 4.5 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.212 -0.93 . . . . 0.0 111.211 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.76 -95.21 0.14 Allowed Glycine 0 N--CA 1.488 2.13 0 N-CA-C 107.356 -2.298 . . . . 0.0 107.356 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.6 mmt-85 -113.4 150.25 32.97 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 24.4 p -144.71 126.41 15.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.971 -1.081 . . . . 0.0 111.509 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.34 146.74 5.87 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . . . . . . . . . 8.8 m -118.48 146.63 44.35 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-O 121.761 0.791 . . . . 0.0 108.934 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.737 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.17 -129.39 0.26 Allowed 'General case' 0 C--N 1.296 -1.728 0 CA-C-O 121.604 0.716 . . . . 0.0 109.352 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.564 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.8 mtt -65.97 26.42 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.737 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.42 -9.04 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 -178.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.1 mtmt -82.17 162.73 22.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.2 mmmt -105.62 174.52 5.85 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -161.21 136.25 7.52 Favored 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.969 -179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' B' ' 571' ' ' GLU . 8.7 m80 -55.49 114.7 7.74 Favored Pre-proline 0 C--N 1.301 -1.531 0 N-CA-C 105.525 -2.028 . . . . 0.0 105.525 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.605 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 45.2 Cg_exo -45.67 -12.84 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.527 0 CA-C-N 120.237 1.12 . . . . 0.0 111.408 -178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.855 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.0 mt-10 -95.73 -52.71 3.98 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.988 0.899 . . . . 0.0 110.252 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.438 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.2 m170 -58.35 -4.0 0.33 Allowed 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.986 -1.071 . . . . 0.0 109.876 -179.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.448 ' H ' ' C ' ' B' ' 571' ' ' GLU . 13.4 t80 -128.93 56.35 1.68 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 178.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.855 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.1 m -94.0 178.02 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 CA-C-O 121.814 0.816 . . . . 0.0 110.898 -178.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.648 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.41 143.82 30.03 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.74 73.61 5.79 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 116.505 -2.078 . . . . 0.0 108.905 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . 0.447 ' HB3' ' SG ' ' B' ' 575' ' ' CYS . 34.9 t80 -154.56 -60.13 0.12 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 102.858 -3.016 . . . . 0.0 102.858 173.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.568 ' O ' ' N ' ' B' ' 580' ' ' LYS . 31.9 p -113.96 79.12 1.21 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 112.534 -2.121 . . . . 0.0 105.413 176.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 0.452 HD23 ' N ' ' B' ' 579' ' ' LEU . 5.9 mt -51.36 14.7 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.006 0 CA-C-N 115.019 -0.992 . . . . 0.0 113.272 -176.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -97.11 -36.84 10.35 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 120.045 -1.66 . . . . 0.0 112.652 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.605 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.18 140.93 13.38 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 119.617 -1.927 . . . . 0.0 114.636 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.648 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.2 tp -134.51 169.97 16.47 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 175.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.427 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 73.5 m-20 -145.49 128.16 16.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.335 -0.853 . . . . 0.0 109.073 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . . . . . . . . . 14.4 ptmt -51.2 -21.53 2.09 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.57 -0.707 . . . . 0.0 109.689 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -84.12 -19.81 60.25 Favored Glycine 0 N--CA 1.486 2.033 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 -179.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.7 p -133.56 28.46 3.97 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.569 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -89.07 105.72 17.97 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 122.932 1.349 . . . . 0.0 110.088 -179.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.528 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -97.51 167.76 10.79 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.5 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.434 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.8 tt0 -152.61 157.37 40.9 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 122.558 1.17 . . . . 0.0 110.711 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.629 ' NE2' ' CD1' ' B' ' 604' ' ' PHE . 0.9 OUTLIER -155.35 146.04 22.23 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 178.773 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.578 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 45.86 23.51 0.17 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.012 -1.055 . . . . 0.0 109.991 -179.701 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.68 -5.11 1.55 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.715 -0.615 . . . . 0.0 111.078 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 32.6 mttm -89.61 123.17 67.26 Favored Pre-proline 0 C--N 1.295 -1.8 0 O-C-N 121.161 -0.962 . . . . 0.0 109.241 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.486 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.8 Cg_exo -48.63 163.94 0.25 Allowed 'Trans proline' 0 N--CA 1.489 1.243 0 CA-C-N 120.051 1.054 . . . . 0.0 111.941 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.528 ' O ' ' N ' ' B' ' 588' ' ' LYS . 11.3 m-85 -170.34 138.43 1.58 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.017 -1.052 . . . . 0.0 110.685 -178.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 39.5 m -75.38 157.39 34.27 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 174.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.605 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.03 -56.69 18.01 Favored 'General case' 0 C--N 1.288 -2.084 0 C-N-CA 117.53 -1.668 . . . . 0.0 106.618 178.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.17 -27.29 0.94 Allowed 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.582 -0.698 . . . . 0.0 109.552 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 87.9 m -85.06 -59.28 2.38 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.484 -0.76 . . . . 0.0 109.01 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.46 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -54.69 -49.48 70.56 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.566 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.706 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -55.73 -40.27 72.25 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 179.757 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.463 ' HD2' HG21 ' A' ' 75' ' ' THR . 0.2 OUTLIER -51.14 -28.32 10.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.491 -0.756 . . . . 0.0 109.52 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.666 HD13 HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -94.08 -57.48 2.52 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.233 -0.917 . . . . 0.0 112.051 -176.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.629 ' CD1' ' NE2' ' B' ' 590' ' ' GLN . 14.6 m-85 -92.23 22.12 4.69 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.809 -1.182 . . . . 0.0 110.598 -178.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.52 ' O ' ' CE1' ' A' ' 76' ' ' HIS . 2.2 m . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.109 -0.995 . . . . 0.0 108.952 179.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.634 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.634 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -151.22 -53.0 0.13 Allowed 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.566 ' C ' ' H ' ' A' ' 5' ' ' GLY . 54.0 mt -46.84 -81.19 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.791 0.805 . . . . 0.0 109.309 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.447 ' OD2' HD11 ' A' ' 6' ' ' ILE . 10.7 t0 60.43 -6.36 0.09 Allowed 'General case' 0 C--N 1.297 -1.68 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.931 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.566 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 117.99 -13.12 12.88 Favored Glycine 0 N--CA 1.493 2.489 0 N-CA-C 107.906 -2.078 . . . . 0.0 107.906 179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.624 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -120.52 -108.14 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 -179.212 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.598 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -168.06 -102.06 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 O-C-N 120.835 -1.165 . . . . 0.0 109.434 179.851 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.598 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -150.68 -64.26 0.02 OUTLIER Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.087 -1.008 . . . . 0.0 110.986 -179.182 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -44.61 -41.36 14.41 Favored 'Trans proline' 0 N--CA 1.493 1.5 0 CA-C-N 121.262 1.487 . . . . 0.0 110.894 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -105.81 -33.73 7.89 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.253 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.11 4.39 58.48 Favored Glycine 0 N--CA 1.482 1.749 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.407 ' N ' ' O ' ' A' ' 8' ' ' MET . 6.9 t -162.36 -76.89 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.561 -0.964 . . . . 0.0 109.341 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.441 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 0.2 OUTLIER -174.02 -60.23 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.257 -0.902 . . . . 0.0 108.76 -179.889 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 176.1 -47.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -147.93 3.84 0.73 Allowed 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.567 -0.708 . . . . 0.0 109.2 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 97.69 26.22 10.04 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.648 -1.781 . . . . 0.0 108.648 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 p -97.91 122.07 40.58 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.661 -0.905 . . . . 0.0 109.771 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CD1' ' N ' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -127.92 130.11 47.94 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.484 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.612 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -82.98 135.72 34.78 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.189 -0.944 . . . . 0.0 110.013 -179.358 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.48 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.0 OUTLIER -84.72 131.33 34.58 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 179.241 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -77.98 144.55 36.65 Favored 'General case' 0 C--N 1.295 -1.802 0 O-C-N 120.9 -1.125 . . . . 0.0 108.326 179.24 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.8 t -139.18 108.58 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 CA-C-O 121.749 0.785 . . . . 0.0 110.314 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.526 ' CE1' ' OD2' ' A' ' 30' ' ' ASP . 14.0 m80 -82.49 105.98 13.99 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.537 ' O ' ' N ' ' A' ' 28' ' ' ASN . 5.4 t -73.45 111.18 7.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 C-N-CA 118.807 -1.157 . . . . 0.0 109.607 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.487 ' C ' ' H ' ' A' ' 27' ' ' LEU . 1.1 p -76.87 165.58 24.5 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 179.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.443 ' CB ' ' O ' ' A' ' 25' ' ' THR . 1.8 t70 72.81 -44.57 0.6 Allowed 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -178.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.506 HD22 ' HD2' ' A' ' 29' ' ' ARG . 5.7 mt -94.25 -31.37 14.12 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 70.93 17.6 6.25 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.804 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.506 ' HD2' HD22 ' A' ' 27' ' ' LEU . 1.0 OUTLIER -89.13 -179.59 5.93 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.698 -1.251 . . . . 0.0 108.872 179.54 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.526 ' OD2' ' CE1' ' A' ' 23' ' ' HIS . 3.1 m-20 -139.91 115.41 9.99 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 17.3 t -115.25 157.41 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 CA-C-O 121.536 0.684 . . . . 0.0 109.966 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.483 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.13 132.76 42.03 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -179.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.483 HD22 ' C ' ' A' ' 32' ' ' THR . 3.7 mm? -115.53 112.91 22.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.636 -0.665 . . . . 0.0 110.372 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.65 109.1 0.95 Allowed 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 178.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.53 -169.27 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 CA-C-O 121.815 0.817 . . . . 0.0 110.218 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.7 p -143.64 174.55 10.69 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.73 44.01 3.04 Favored Glycine 0 N--CA 1.483 1.801 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.452 ' C ' HG21 ' A' ' 78' ' ' THR . 4.2 pt-20 -145.37 3.82 1.02 Allowed 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.592 ' O ' HG22 ' A' ' 78' ' ' THR . 2.4 m -89.16 143.3 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 120.92 -1.113 . . . . 0.0 110.072 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.511 ' O ' ' N ' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -80.16 141.83 35.33 Favored 'General case' 0 C--N 1.293 -1.881 0 O-C-N 120.888 -1.133 . . . . 0.0 108.126 178.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.464 ' C ' ' N ' ' A' ' 43' ' ' GLY . 19.6 mt -47.27 -58.32 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.047 -1.033 . . . . 0.0 109.495 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.406 ' H ' HG23 ' A' ' 75' ' ' THR . . . -54.38 -13.59 4.04 Favored Glycine 0 N--CA 1.487 2.067 0 N-CA-C 108.023 -2.031 . . . . 0.0 108.023 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -72.6 -28.47 67.36 Favored Glycine 0 N--CA 1.486 1.978 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.95 -35.58 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.7 mtm -51.02 -37.72 46.91 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.606 HD12 HD13 ' B' ' 603' ' ' LEU . 0.6 OUTLIER -70.32 -63.75 1.03 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.836 -0.54 . . . . 0.0 109.843 -179.192 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.429 ' HB2' HD12 ' A' ' 33' ' ' LEU . 32.8 mttt -53.34 -56.54 15.88 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.192 -0.942 . . . . 0.0 111.37 -178.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.466 HD21 ' CD2' ' A' ' 92' ' ' PHE . 53.6 tp -45.46 -34.15 3.03 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.846 -1.159 . . . . 0.0 110.215 -177.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 19.4 t -80.46 -44.12 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 120.985 -1.072 . . . . 0.0 109.114 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -43.11 -33.89 0.96 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.527 0.679 . . . . 0.0 109.969 -178.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mtmt -83.72 -39.76 19.73 Favored 'General case' 0 C--N 1.296 -1.726 0 O-C-N 121.539 -0.726 . . . . 0.0 110.43 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.431 HD23 ' CG1' ' A' ' 54' ' ' VAL . 10.9 tp -51.23 -60.58 2.96 Favored 'General case' 0 N--CA 1.484 1.249 0 O-C-N 121.133 -0.979 . . . . 0.0 108.969 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.1 t0 68.73 78.83 0.22 Allowed 'General case' 0 C--N 1.3 -1.554 0 CA-C-O 121.861 0.838 . . . . 0.0 110.424 178.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.514 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.8 p -173.78 142.07 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.06 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.463 ' CG ' ' O ' ' A' ' 55' ' ' LYS . 15.1 tttt -71.28 39.81 0.06 Allowed 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.554 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 54' ' ' VAL . 18.7 ttmm -77.47 154.15 32.84 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 178.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.53 91.2 7.36 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 0.1 OUTLIER -80.59 -44.17 19.39 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 122.129 0.966 . . . . 0.0 109.015 -179.861 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.499 ' C ' ' H ' ' A' ' 61' ' ' HIS . 58.4 p -39.82 -55.31 1.99 Allowed 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.166 -178.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -52.41 -8.05 0.07 Allowed 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.191 -0.943 . . . . 0.0 109.517 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 0.7 OUTLIER -98.27 173.32 7.05 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 122.319 1.057 . . . . 0.0 110.771 -179.233 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.507 ' N ' ' CD2' ' A' ' 61' ' ' HIS . . . -168.19 162.18 12.73 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.822 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.4 mm? -94.75 145.9 24.55 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.182 -0.949 . . . . 0.0 109.347 -179.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.478 ' HE1' ' CD ' ' A' ' 91' ' ' GLN . 0.0 OUTLIER -128.11 148.53 50.58 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.27 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.538 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -106.08 91.07 3.57 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.056 -1.027 . . . . 0.0 108.527 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.406 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 11.1 pt-20 -55.64 -21.77 19.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.064 -1.023 . . . . 0.0 111.037 -178.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.499 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -66.07 -17.73 64.89 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 178.138 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -125.97 -11.92 6.49 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.623 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.0 mpp_? 53.69 46.41 25.97 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 -177.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -113.03 -171.62 1.9 Allowed 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.365 0.602 . . . . 0.0 109.851 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.552 ' CD1' ' N ' ' A' ' 71' ' ' TRP . 0.0 OUTLIER -128.34 99.46 5.43 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 177.496 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -60.36 82.28 0.01 OUTLIER 'General case' 0 C--N 1.292 -1.926 0 CA-C-O 122.372 1.082 . . . . 0.0 110.673 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.5 pp -118.33 5.74 11.86 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.414 ' HE3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.48 55.54 2.32 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.539 HG21 ' O ' ' B' ' 602' ' ' LYS . 12.6 m -47.77 -25.06 1.12 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.047 -1.033 . . . . 0.0 109.218 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.1 158.32 13.99 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.487 -0.758 . . . . 0.0 109.461 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 45.1 m95 57.34 -138.16 0.94 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.662 -0.649 . . . . 0.0 110.05 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.592 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -155.63 -162.8 1.38 Allowed 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 118.527 -1.269 . . . . 0.0 111.583 -179.055 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.609 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.6 mp -72.46 -56.34 5.57 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -43.02 -49.41 6.07 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.629 -1.168 . . . . 0.0 111.188 -179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.54 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -56.63 -30.6 63.47 Favored 'General case' 0 C--N 1.296 -1.735 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.475 -178.3 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.54 ' N ' ' HD3' ' A' ' 81' ' ' LYS . 0.3 OUTLIER -82.88 -49.0 10.12 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.848 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 118.11 7.83 11.05 Favored Glycine 0 N--CA 1.499 2.88 0 N-CA-C 108.161 -1.976 . . . . 0.0 108.161 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.544 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 30.3 mt -60.66 161.36 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.544 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -155.75 -163.06 1.42 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.962 -1.086 . . . . 0.0 109.64 179.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.88 -24.18 59.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.49 -0.756 . . . . 0.0 110.75 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -84.77 3.17 38.81 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.43 -0.794 . . . . 0.0 109.756 -178.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.48 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -91.72 112.68 24.7 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.543 -0.723 . . . . 0.0 109.332 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -97.78 117.87 33.05 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.92 -1.113 . . . . 0.0 109.894 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.419 ' HG ' HD12 ' A' ' 20' ' ' LEU . 2.5 mt -103.6 178.01 4.68 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.478 ' CD ' ' HE1' ' A' ' 64' ' ' TRP . 5.7 mt-30 -131.52 157.92 42.28 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.0 OUTLIER -122.79 93.4 3.95 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.817 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.57 149.54 41.82 Favored Pre-proline 0 N--CA 1.504 2.229 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.361 -178.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo . . . . . 0 N--CA 1.496 1.666 0 C-N-CA 122.547 2.165 . . . . 0.0 111.907 179.477 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . 0.436 ' O ' ' O ' ' B' ' 542' ' ' HIS . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . 0.436 ' O ' ' O ' ' B' ' 541' ' ' TYR . 71.2 m80 -61.92 -140.78 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 O-C-N 121.262 -0.899 . . . . 0.0 109.498 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.421 ' O ' ' C ' ' B' ' 544' ' ' ARG . 20.1 pt-20 -173.62 -24.82 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.23 -0.919 . . . . 0.0 110.102 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.494 ' N ' ' CD ' ' B' ' 544' ' ' ARG . 0.3 OUTLIER 39.88 88.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.572 -0.705 . . . . 0.0 110.3 179.626 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -59.14 -77.38 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.378 -0.826 . . . . 0.0 110.294 -179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -120.83 -90.64 1.16 Allowed Glycine 0 N--CA 1.501 3.017 0 N-CA-C 110.596 -1.002 . . . . 0.0 110.596 -179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.538 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -174.3 122.45 0.29 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.244 -1.151 . . . . 0.0 108.223 -178.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.26 136.17 57.95 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.627 -1.296 . . . . 0.0 110.474 -178.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.512 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.4 OUTLIER -83.89 103.51 13.22 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 105.38 -2.081 . . . . 0.0 105.38 178.094 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.4 t -52.11 128.83 25.89 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 122.315 1.055 . . . . 0.0 110.872 -176.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.71 -25.43 28.34 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 106.433 -2.667 . . . . 0.0 106.433 -178.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 2.0 t -112.78 -29.99 7.22 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' B' ' 549' ' ' CYS . 17.3 mm-40 46.88 57.46 5.61 Favored 'General case' 0 N--CA 1.49 1.563 0 CA-C-O 122.525 1.155 . . . . 0.0 112.779 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -142.51 125.92 9.47 Favored Pre-proline 0 C--N 1.286 -2.184 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 176.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -44.34 134.94 9.05 Favored 'Trans proline' 0 N--CA 1.49 1.313 0 CA-C-N 120.412 1.183 . . . . 0.0 114.596 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' B' ' 547' ' ' SER . 38.4 mt -94.37 98.04 7.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 5.3 p -100.54 90.94 4.45 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.273 -0.892 . . . . 0.0 111.194 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.11 -96.33 0.16 Allowed Glycine 0 N--CA 1.488 2.106 0 N-CA-C 107.553 -2.219 . . . . 0.0 107.553 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.483 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.0 mmt-85 -110.83 150.54 29.0 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 178.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 25.3 p -144.73 126.26 15.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.006 -1.059 . . . . 0.0 111.677 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -91.27 146.49 6.17 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 178.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.434 ' H ' ' HE3' ' B' ' 584' ' ' LYS . 8.9 m -119.93 146.45 45.79 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-O 121.803 0.811 . . . . 0.0 109.02 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.74 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -122.21 -129.29 0.27 Allowed 'General case' 0 C--N 1.294 -1.805 0 CA-C-O 121.517 0.675 . . . . 0.0 109.538 -178.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.56 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 13.7 mtm -66.09 26.57 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.74 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.62 -9.38 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . 0.451 ' NZ ' ' CE ' ' B' ' 564' ' ' MET . 13.1 mtmt -81.53 161.14 23.7 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 16.5 mmmt -103.29 174.4 5.88 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -160.11 134.9 7.74 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.207 -1.397 . . . . 0.0 109.911 -179.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.556 ' O ' ' N ' ' B' ' 571' ' ' GLU . 4.4 m80 -55.84 114.9 8.28 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 176.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.601 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.4 Cg_exo -47.22 -12.49 0.11 Allowed 'Trans proline' 0 C--N 1.309 -1.534 0 CA-C-N 120.47 1.204 . . . . 0.0 110.703 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.844 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.5 mt-10 -94.57 -52.46 4.3 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.046 0.927 . . . . 0.0 110.314 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.458 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 18.7 m170 -60.67 -3.67 0.77 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.958 -1.089 . . . . 0.0 109.812 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.414 ' H ' ' C ' ' B' ' 571' ' ' GLU . 25.5 t80 -128.84 55.78 1.7 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.844 HG13 ' O ' ' B' ' 571' ' ' GLU . 15.4 m -94.52 178.2 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-O 121.85 0.833 . . . . 0.0 111.24 -178.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.658 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -83.8 142.59 30.54 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 178.76 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -92.6 75.22 5.07 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 116.717 -1.993 . . . . 0.0 109.289 178.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -153.05 -51.58 0.1 Allowed 'General case' 0 N--CA 1.506 2.331 0 N-CA-C 102.413 -3.18 . . . . 0.0 102.413 173.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.553 ' O ' ' N ' ' B' ' 580' ' ' LYS . 28.1 p -129.64 80.53 1.97 Allowed 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 111.94 -2.391 . . . . 0.0 105.299 177.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.85 15.1 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -176.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.553 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -87.99 -37.22 16.54 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 119.733 -1.854 . . . . 0.0 112.112 -178.907 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.601 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.9 tp60 -160.13 139.82 11.23 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 119.624 -1.923 . . . . 0.0 114.907 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' B' ' 575' ' ' CYS . 21.8 tp -135.81 169.35 17.7 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 175.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 71.2 m-20 -142.53 143.34 32.46 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.333 -0.855 . . . . 0.0 108.891 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.434 ' HE3' ' H ' ' B' ' 562' ' ' THR . 11.4 ptpt -64.14 -17.24 63.28 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.478 -0.763 . . . . 0.0 109.773 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.59 -17.14 55.56 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 -179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 2.5 p -133.08 27.14 4.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.933 -0.745 . . . . 0.0 109.363 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.517 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.0 OUTLIER -88.72 111.24 21.74 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 122.593 1.187 . . . . 0.0 109.331 179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.514 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -102.76 168.89 8.95 Favored 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.8 tt0 -151.84 157.07 41.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.729 -1.232 . . . . 0.0 110.797 -178.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.539 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 2.5 tp60 -158.59 146.45 18.12 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 178.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.622 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 48.24 22.56 0.45 Allowed 'General case' 0 C--N 1.295 -1.783 0 O-C-N 120.911 -1.118 . . . . 0.0 109.547 -179.434 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 0.8 OUTLIER 79.44 -3.69 2.08 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.732 -0.605 . . . . 0.0 110.933 178.519 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -91.03 125.44 58.74 Favored Pre-proline 0 C--N 1.294 -1.81 0 O-C-N 121.265 -0.897 . . . . 0.0 109.39 -179.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 48.6 Cg_exo -48.87 165.77 0.17 Allowed 'Trans proline' 0 N--CA 1.492 1.404 0 CA-C-N 120.15 1.089 . . . . 0.0 111.955 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 13.0 m-85 -171.1 136.89 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.9 -1.125 . . . . 0.0 111.066 -178.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 23.3 m -73.05 154.55 40.4 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 174.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.564 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.77 -58.14 9.85 Favored 'General case' 0 C--N 1.288 -2.081 0 C-N-CA 117.525 -1.67 . . . . 0.0 106.582 179.28 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -46.04 -26.17 0.69 Allowed 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.639 -0.663 . . . . 0.0 109.714 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 95.1 m -85.36 -64.48 1.15 Allowed 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.533 -0.73 . . . . 0.0 109.389 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -50.98 -53.56 32.06 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.344 -0.847 . . . . 0.0 108.856 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.719 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.2 OUTLIER -50.51 -41.87 54.15 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.539 ' O ' HG21 ' A' ' 75' ' ' THR . 0.2 OUTLIER -53.38 -24.42 12.27 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.452 -0.78 . . . . 0.0 109.087 179.558 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.606 HD13 HD12 ' A' ' 46' ' ' LEU . 3.6 mt -94.16 -56.97 2.66 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.281 -0.887 . . . . 0.0 111.5 -178.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.515 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 51.7 m-85 -105.1 -28.49 10.98 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.136 -0.978 . . . . 0.0 110.953 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 5.2 p . . . . . 0 N--CA 1.497 1.9 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.949 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ttt . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -158.76 -49.33 0.06 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.098 -1.001 . . . . 0.0 109.138 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.564 ' C ' ' H ' ' A' ' 5' ' ' GLY . 57.5 mt -44.09 -78.14 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 CA-C-O 121.945 0.879 . . . . 0.0 109.792 179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.457 ' OD1' HD11 ' A' ' 6' ' ' ILE . 7.5 t0 60.81 -6.56 0.09 Allowed 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.679 -179.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.564 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . 116.96 -12.57 14.62 Favored Glycine 0 N--CA 1.492 2.423 0 N-CA-C 108.029 -2.028 . . . . 0.0 108.029 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.636 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -118.48 -109.14 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 -179.129 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.5 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -157.61 -95.1 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 O-C-N 120.392 -1.442 . . . . 0.0 110.439 -179.485 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.5 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -131.05 -54.0 0.03 OUTLIER Pre-proline 0 N--CA 1.51 2.567 0 O-C-N 120.96 -1.087 . . . . 0.0 111.685 -179.004 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -55.04 -33.43 83.33 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 CA-C-N 121.078 1.421 . . . . 0.0 110.242 179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -114.16 -26.59 7.99 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -82.72 4.92 77.2 Favored Glycine 0 N--CA 1.484 1.866 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.51 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 10.2 t -163.56 -44.17 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.207 -1.172 . . . . 0.0 109.716 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.678 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 8.2 t80 88.41 -79.98 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.678 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 164.87 -37.14 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.472 -0.768 . . . . 0.0 108.993 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -135.48 0.51 2.77 Favored 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 18' ' ' TRP . . . 62.81 44.39 97.54 Favored Glycine 0 N--CA 1.488 2.165 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.574 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -76.92 126.55 31.16 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.416 -1.05 . . . . 0.0 110.379 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.4 ' CD2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -130.68 119.76 22.88 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 177.89 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.9 127.83 33.9 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.11 -1.036 . . . . 0.0 109.008 -179.375 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.54 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -83.52 134.3 34.84 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 179.447 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 t -78.21 145.68 35.4 Favored 'General case' 0 C--N 1.294 -1.822 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.433 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 24.5 t -136.81 105.3 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 CA-C-O 121.817 0.817 . . . . 0.0 109.525 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.53 ' CD2' ' OD2' ' A' ' 30' ' ' ASP . 12.1 m80 -78.79 103.71 8.92 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 178.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.54 ' O ' ' N ' ' A' ' 28' ' ' ASN . 2.5 t -72.28 113.3 9.23 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 C-N-CA 118.613 -1.235 . . . . 0.0 107.972 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.477 ' C ' ' H ' ' A' ' 27' ' ' LEU . 30.3 p -80.84 -36.94 30.83 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.392 -0.817 . . . . 0.0 109.873 -178.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -71.34 9.55 0.77 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.946 -1.096 . . . . 0.0 108.654 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 25' ' ' THR . 2.9 mt -147.06 -29.07 0.37 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.585 -0.697 . . . . 0.0 109.294 -178.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 80.78 12.5 0.84 Allowed 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -179.424 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -94.29 -178.26 4.54 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 120.997 -1.065 . . . . 0.0 109.495 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.53 ' OD2' ' CD2' ' A' ' 23' ' ' HIS . 3.5 m-20 -136.0 114.99 12.24 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 178.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG12 ' N ' ' A' ' 32' ' ' THR . 25.8 t -112.35 157.59 13.06 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 -179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.493 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -132.46 133.99 44.53 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 -179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.493 HD22 ' C ' ' A' ' 32' ' ' THR . 3.6 mm? -113.76 113.01 24.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.645 -0.659 . . . . 0.0 109.695 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.574 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 14.7 tpt180 -60.12 102.38 0.16 Allowed 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 23.8 m -132.96 -169.75 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 CA-C-O 121.918 0.866 . . . . 0.0 110.854 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.3 p -145.26 176.43 9.55 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -79.33 46.58 3.04 Favored Glycine 0 C--N 1.295 -1.729 0 N-CA-C 109.153 -1.579 . . . . 0.0 109.153 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.439 ' C ' HG21 ' A' ' 78' ' ' THR . 4.2 pt-20 -147.01 0.23 0.72 Allowed 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.203 -1.175 . . . . 0.0 108.669 179.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.4 m -89.76 128.21 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 120.97 -1.081 . . . . 0.0 109.691 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' O ' ' N ' ' A' ' 43' ' ' GLY . 7.6 m80 -66.92 144.15 56.41 Favored 'General case' 0 C--N 1.291 -1.957 0 O-C-N 121.001 -1.062 . . . . 0.0 108.887 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.519 HD13 ' HB3' ' A' ' 72' ' ' LEU . 96.4 mt -46.22 -56.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.194 -0.941 . . . . 0.0 109.365 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.591 ' H ' HG23 ' A' ' 75' ' ' THR . . . -57.24 -14.86 13.0 Favored Glycine 0 C--N 1.296 -1.661 0 N-CA-C 108.741 -1.744 . . . . 0.0 108.741 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -77.29 -18.69 77.86 Favored Glycine 0 N--CA 1.485 1.905 0 N-CA-C 109.131 -1.588 . . . . 0.0 109.131 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 t -83.41 -50.76 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.385 -1.068 . . . . 0.0 109.063 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 11.6 mtm -50.41 -39.66 47.82 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.867 -1.145 . . . . 0.0 108.542 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.704 HD12 HD13 ' B' ' 603' ' ' LEU . 6.7 tt -56.98 -53.87 53.19 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.41 ' CB ' HD12 ' A' ' 33' ' ' LEU . 55.1 mttm -67.27 -52.84 35.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.12 -0.988 . . . . 0.0 110.7 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.1 tp -44.77 -40.48 6.11 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.142 -0.974 . . . . 0.0 110.163 -178.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.5 t -78.07 -45.68 27.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.927 -1.108 . . . . 0.0 109.952 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -44.67 -37.43 3.67 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.349 -0.844 . . . . 0.0 109.831 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.523 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.8 mtmp? -75.87 -39.04 57.25 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.46 -0.775 . . . . 0.0 110.775 -179.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.442 ' O ' ' CB ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -62.03 -67.56 0.4 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.039 -1.038 . . . . 0.0 109.089 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' A' ' 52' ' ' LEU . 3.9 t70 75.76 80.83 0.1 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 121.97 0.891 . . . . 0.0 110.142 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.497 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.3 p -172.52 142.06 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.29 -2.005 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mttp -68.04 31.83 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.342 -0.849 . . . . 0.0 110.833 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.497 ' H ' ' C ' ' A' ' 54' ' ' VAL . 1.6 tppp? -79.86 142.15 35.49 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.859 -1.151 . . . . 0.0 108.268 178.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -60.0 115.77 3.67 Favored 'General case' 0 C--N 1.3 -1.551 0 O-C-N 121.477 -0.765 . . . . 0.0 110.03 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.424 ' CD1' ' O ' ' A' ' 56' ' ' LYS . 71.2 m95 -119.67 -43.79 2.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.569 -0.707 . . . . 0.0 109.788 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.5 t -48.67 -56.04 9.63 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.954 -1.091 . . . . 0.0 110.094 -178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.62 -36.84 47.46 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.133 -0.979 . . . . 0.0 108.904 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.408 ' O ' ' CZ ' ' A' ' 92' ' ' PHE . 14.7 m170 -72.49 128.02 34.34 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.888 0.851 . . . . 0.0 110.586 -179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.68 160.11 27.89 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 179.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.496 ' HA ' ' O ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER -99.7 148.63 24.16 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-O 122.274 1.035 . . . . 0.0 110.031 -178.65 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.47 ' CD1' ' C ' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -127.07 151.28 48.83 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 -177.191 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.647 ' HB2' HD21 ' A' ' 72' ' ' LEU . 5.2 t90 -100.73 90.5 4.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 120.8 -1.188 . . . . 0.0 108.674 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.416 ' HB3' ' HE1' ' A' ' 64' ' ' TRP . 9.2 pt-20 -54.59 -23.17 15.75 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.17 -0.956 . . . . 0.0 110.91 -178.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.504 ' CG ' ' HE1' ' A' ' 65' ' ' TRP . 15.7 mmtp -67.48 -10.7 53.97 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 106.027 -1.842 . . . . 0.0 106.027 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -133.93 -11.48 2.62 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.162 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' A' ' 65' ' ' TRP . 1.1 mpp_? 52.92 45.92 27.81 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 -178.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 64' ' ' TRP . 5.0 t -111.81 -169.91 1.55 Allowed 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.282 0.563 . . . . 0.0 109.933 -178.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.489 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -128.24 103.9 7.44 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 177.707 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 65' ' ' TRP . 10.1 mt -63.23 82.57 0.02 OUTLIER 'General case' 0 C--N 1.279 -2.468 0 O-C-N 120.479 -1.388 . . . . 0.0 110.318 -176.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 71' ' ' TRP . 2.2 pp -113.59 15.19 18.98 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 178.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HZ1' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -84.22 61.11 6.34 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.647 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.591 HG23 ' H ' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -75.12 -5.86 46.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.066 -1.021 . . . . 0.0 109.419 -179.695 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.423 ' ND1' ' N ' ' A' ' 76' ' ' HIS . 6.4 m80 -68.79 -53.04 23.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.338 -0.852 . . . . 0.0 110.782 -179.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 -97.24 -128.31 0.16 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.218 -0.926 . . . . 0.0 109.906 -178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.455 ' O ' ' N ' ' A' ' 81' ' ' LYS . 0.2 OUTLIER -153.33 150.79 29.26 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.411 -1.431 . . . . 0.0 108.867 -179.371 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.678 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -40.1 -49.32 2.58 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.504 -0.748 . . . . 0.0 111.224 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.452 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 23.0 t70 -46.91 -34.78 5.76 Favored 'General case' 0 C--N 1.293 -1.876 0 O-C-N 121.187 -0.945 . . . . 0.0 109.413 178.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.492 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -66.77 -30.44 70.65 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 -179.627 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.534 ' N ' ' O ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -79.31 -51.66 9.14 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 178.048 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 123.6 9.9 5.66 Favored Glycine 0 N--CA 1.51 3.598 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.524 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 53.2 mt -60.87 161.86 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.036 0 O-C-N 122.2 -0.588 . . . . 0.0 109.446 179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -162.53 -159.02 0.54 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.255 -0.903 . . . . 0.0 109.279 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.68 -26.05 60.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.329 -0.857 . . . . 0.0 109.732 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -79.83 -1.81 40.64 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 109.111 -179.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.5 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.35 113.48 25.82 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.523 -0.736 . . . . 0.0 109.059 -179.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.1 mmtp -98.05 115.43 28.21 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.897 -1.127 . . . . 0.0 110.255 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.54 ' HG ' HD12 ' A' ' 20' ' ' LEU . 8.1 mt -91.54 176.29 6.6 Favored 'General case' 0 C--N 1.299 -1.628 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 178.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.496 ' O ' ' HA ' ' A' ' 63' ' ' LEU . 2.6 mt-30 -142.27 148.24 37.75 Favored 'General case' 0 N--CA 1.5 2.054 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.408 ' CZ ' ' O ' ' A' ' 61' ' ' HIS . 10.0 t80 -111.34 90.88 3.46 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.447 ' CB ' ' CD ' ' A' ' 94' ' ' PRO . 0.1 OUTLIER -107.57 -177.58 0.5 Allowed Pre-proline 0 N--CA 1.504 2.235 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.531 -178.134 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . 0.447 ' CD ' ' CB ' ' A' ' 93' ' ' THR . 37.2 Cg_exo . . . . . 0 N--CA 1.5 1.878 0 C-N-CA 122.639 2.226 . . . . 0.0 112.12 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 51.9 t80 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -82.32 -161.92 0.51 Allowed 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.232 -0.918 . . . . 0.0 109.725 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.439 ' CD ' ' HE ' ' B' ' 545' ' ' ARG . 0.4 OUTLIER -177.42 91.46 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 179.338 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -98.1 65.6 1.75 Allowed 'General case' 0 C--N 1.293 -1.863 0 O-C-N 121.869 -0.519 . . . . 0.0 110.689 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.439 ' HE ' ' CD ' ' B' ' 543' ' ' GLU . 18.5 mmt180 -64.3 -141.58 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.376 0 O-C-N 120.637 -1.289 . . . . 0.0 109.552 179.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . 159.06 -85.82 0.12 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.547 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.3 m -166.18 119.51 1.1 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.27 136.71 58.12 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.887 -1.133 . . . . 0.0 110.527 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.553 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.1 OUTLIER -83.72 102.86 12.57 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 105.571 -2.011 . . . . 0.0 105.571 178.358 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 3.7 t -49.21 127.5 14.86 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.175 0.988 . . . . 0.0 110.654 -177.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 100.57 -26.2 25.47 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 106.788 -2.525 . . . . 0.0 106.788 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 6.4 t -110.51 -30.93 7.43 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.419 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.2 mm-40 47.46 57.04 6.24 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-O 122.711 1.243 . . . . 0.0 112.02 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 37.3 mmtm -142.44 125.58 9.38 Favored Pre-proline 0 C--N 1.287 -2.135 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -44.03 136.41 7.62 Favored 'Trans proline' 0 N--CA 1.492 1.402 0 CA-C-N 120.415 1.184 . . . . 0.0 114.582 -178.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.553 HD11 ' HA ' ' B' ' 549' ' ' CYS . 43.8 mt -94.9 98.41 7.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . 0.404 ' O ' ' OG1' ' B' ' 557' ' ' THR . 3.6 p -99.48 91.01 4.71 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.998 0.904 . . . . 0.0 111.179 -178.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 155.06 -96.82 0.16 Allowed Glycine 0 N--CA 1.488 2.126 0 N-CA-C 107.675 -2.17 . . . . 0.0 107.675 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.47 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 9.3 mmt180 -113.12 153.31 28.42 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 178.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 20.7 p -144.09 126.5 15.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.014 -1.054 . . . . 0.0 111.558 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 51.6 mt -90.03 145.52 7.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.472 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 9.8 m -121.95 146.38 47.2 Favored 'General case' 0 C--N 1.29 -2.006 0 CA-C-O 121.965 0.888 . . . . 0.0 109.193 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.742 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.34 -128.85 0.26 Allowed 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.553 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 7.8 mtt -65.44 25.63 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.593 -0.692 . . . . 0.0 109.255 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.742 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.07 -8.66 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 -178.082 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.57 148.94 28.87 Favored 'General case' 0 C--N 1.306 -1.283 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -95.13 174.19 7.19 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -159.95 132.05 6.3 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 118.56 -1.256 . . . . 0.0 109.81 -179.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.569 ' O ' ' N ' ' B' ' 571' ' ' GLU . 1.4 m80 -54.56 117.83 14.74 Favored Pre-proline 0 C--N 1.299 -1.593 0 N-CA-C 105.398 -2.075 . . . . 0.0 105.398 176.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.585 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 32.1 Cg_exo -48.6 -9.77 0.09 OUTLIER 'Trans proline' 0 C--N 1.303 -1.828 0 CA-C-N 120.48 1.207 . . . . 0.0 110.272 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.899 ' O ' HG13 ' B' ' 574' ' ' VAL . 7.0 mt-10 -97.58 -52.85 3.63 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.62 0.724 . . . . 0.0 110.56 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -59.96 -2.72 0.44 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.612 -1.305 . . . . 0.0 109.685 -178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.445 ' H ' ' C ' ' B' ' 571' ' ' GLU . 5.8 t80 -128.06 56.6 1.59 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 107.645 -1.242 . . . . 0.0 107.645 178.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.899 HG13 ' O ' ' B' ' 571' ' ' GLU . 17.0 m -95.1 177.82 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 CA-C-O 121.718 0.77 . . . . 0.0 111.5 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.619 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.87 145.86 30.15 Favored 'General case' 0 N--CA 1.505 2.303 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.244 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -95.72 76.33 3.22 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 116.915 -1.914 . . . . 0.0 109.949 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -152.57 -60.53 0.15 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 101.252 -3.61 . . . . 0.0 101.252 173.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.535 ' O ' ' N ' ' B' ' 580' ' ' LYS . 21.5 p -121.04 81.51 1.79 Allowed 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 111.659 -2.518 . . . . 0.0 104.803 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 0.461 HD12 ' H ' ' B' ' 579' ' ' LEU . 2.9 mp -53.62 16.88 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -176.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -86.0 -36.9 19.49 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 119.585 -1.947 . . . . 0.0 112.522 -178.613 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.585 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 6.0 tp60 -159.27 140.09 12.57 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 119.465 -2.022 . . . . 0.0 115.073 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.619 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.3 tp -139.99 170.48 15.78 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 175.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.464 ' O ' ' N ' ' B' ' 587' ' ' PHE . 60.5 m-20 -149.38 134.55 18.18 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.101 -1.0 . . . . 0.0 109.098 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.472 ' CE ' ' O ' ' B' ' 562' ' ' THR . 12.3 ptpt -51.91 -19.37 1.73 Allowed 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.456 -0.778 . . . . 0.0 109.634 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -88.31 -18.26 55.73 Favored Glycine 0 N--CA 1.486 2.001 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 1.5 p -134.05 25.41 3.91 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.557 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 0.4 OUTLIER -90.3 109.01 20.12 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-O 122.5 1.143 . . . . 0.0 110.232 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.486 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -104.58 169.0 8.72 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.694 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.432 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 8.3 tt0 -152.38 157.23 40.98 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.678 -1.264 . . . . 0.0 110.781 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.502 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 2.8 tp60 -155.0 146.44 23.06 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 178.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.535 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 45.56 23.65 0.15 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.997 -1.064 . . . . 0.0 109.909 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.486 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.4 m-20 82.49 -5.95 1.35 Allowed 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.816 -0.553 . . . . 0.0 110.768 178.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -90.27 118.91 69.18 Favored Pre-proline 0 C--N 1.295 -1.78 0 O-C-N 121.158 -0.964 . . . . 0.0 109.652 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.522 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 38.2 Cg_exo -49.27 164.98 0.25 Allowed 'Trans proline' 0 N--CA 1.491 1.335 0 CA-C-N 119.996 1.034 . . . . 0.0 112.288 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.522 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 22.5 m-85 -170.8 139.58 1.52 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.224 -0.923 . . . . 0.0 109.866 -179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 4.1 m -70.02 154.63 41.7 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 175.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.545 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -58.08 -55.53 33.79 Favored 'General case' 0 C--N 1.292 -1.924 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 179.183 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.98 -29.32 4.68 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.41 -58.47 3.11 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.613 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.2 OUTLIER -60.27 -59.48 5.35 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.81 -0.556 . . . . 0.0 110.246 -179.764 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.71 HD12 ' O ' ' B' ' 601' ' ' LEU . 0.1 OUTLIER -46.55 -38.7 9.79 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.366 -0.834 . . . . 0.0 109.36 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.531 ' O ' HG21 ' A' ' 75' ' ' THR . 17.4 tptm -63.19 -20.71 65.66 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.542 -0.724 . . . . 0.0 110.855 -179.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.704 HD13 HD12 ' A' ' 46' ' ' LEU . 3.0 mt -92.11 -57.3 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 120.75 -1.219 . . . . 0.0 111.239 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.49 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 10.5 m-85 -96.07 12.03 32.08 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.16 -0.963 . . . . 0.0 109.905 -178.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.49 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 26.4 m . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.25 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.5 mmt . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 122.001 0.905 . . . . 0.0 108.948 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 5' ' ' GLY . . . 178.61 -8.33 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.804 -0.814 . . . . 0.0 108.804 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.435 ' C ' ' H ' ' A' ' 5' ' ' GLY . 1.7 mp -43.28 -65.71 0.46 Allowed 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.55 1.167 . . . . 0.0 109.87 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.427 ' C ' ' N ' ' A' ' 6' ' ' ILE . 19.1 t70 -76.91 12.71 1.26 Allowed 'General case' 0 C--N 1.287 -2.137 0 CA-C-N 114.891 -1.05 . . . . 0.0 108.545 -179.336 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 3' ' ' LEU . . . -59.54 -13.79 25.12 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 107.432 -2.267 . . . . 0.0 107.432 179.269 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.668 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -114.61 -110.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 -179.66 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HB3' ' H ' ' A' ' 8' ' ' MET . 4.2 tpp180 -173.47 -87.97 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.235 0 O-C-N 120.86 -1.15 . . . . 0.0 111.159 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.412 ' H ' ' HB3' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -117.96 -51.81 0.04 OUTLIER Pre-proline 0 N--CA 1.501 2.096 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -176.373 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -57.1 -37.8 97.33 Favored 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 121.624 1.55 . . . . 0.0 111.407 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.85 -20.59 5.37 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.12 0.88 88.96 Favored Glycine 0 N--CA 1.486 1.998 0 N-CA-C 108.719 -1.752 . . . . 0.0 108.719 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.562 ' O ' ' N ' ' A' ' 14' ' ' ALA . 38.4 t -153.13 -52.62 0.11 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.557 -0.966 . . . . 0.0 109.486 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.66 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 0.8 OUTLIER 61.93 -74.68 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -179.242 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 164.69 -37.78 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -156.63 7.52 0.19 Allowed 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.391 -0.818 . . . . 0.0 109.68 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.49 16.69 70.46 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.198 -1.961 . . . . 0.0 108.198 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.502 ' OG1' ' NE ' ' A' ' 34' ' ' ARG . 21.8 p -89.98 124.14 34.49 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.809 -0.818 . . . . 0.0 110.619 -178.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -119.0 122.15 41.52 Favored 'General case' 0 N--CA 1.495 1.792 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 177.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.626 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -79.37 128.78 33.76 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.106 -0.996 . . . . 0.0 109.975 -178.837 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.5 HD12 ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -84.47 133.96 34.46 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.776 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -78.57 145.81 34.59 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.23 -0.919 . . . . 0.0 110.287 -178.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.4 t -135.31 107.31 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 CA-C-O 121.802 0.81 . . . . 0.0 109.117 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -78.62 103.71 8.75 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.4 t -71.24 98.92 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.498 ' C ' ' H ' ' A' ' 27' ' ' LEU . 19.7 p -68.19 -48.56 64.91 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.826 -0.546 . . . . 0.0 111.161 -177.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.91 12.22 0.23 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.753 -1.217 . . . . 0.0 109.698 -179.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.498 ' H ' ' C ' ' A' ' 25' ' ' THR . 1.5 mt -141.36 -24.98 0.72 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.561 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 77.15 13.25 2.08 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 122.041 -0.412 . . . . 0.0 110.234 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.5 mtp-105 -96.92 -178.16 4.13 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 120.966 -1.084 . . . . 0.0 109.687 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -137.51 114.23 10.47 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 178.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.435 HG12 ' N ' ' A' ' 32' ' ' THR . 30.3 t -110.65 157.65 11.35 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 -179.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.593 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -131.72 135.3 46.73 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 -179.495 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.594 HD22 ' N ' ' A' ' 33' ' ' LEU . 3.8 mm? -109.15 110.44 21.67 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.685 -0.634 . . . . 0.0 109.416 -179.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.502 ' NE ' ' OG1' ' A' ' 17' ' ' THR . 11.9 tpt180 -60.87 101.73 0.16 Allowed 'General case' 0 C--N 1.292 -1.909 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.7 m -133.55 -169.63 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-O 122.187 0.994 . . . . 0.0 110.742 -178.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.7 p -142.4 174.51 10.56 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -80.26 45.51 3.04 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.442 ' C ' HG21 ' A' ' 78' ' ' THR . 1.4 pp20? -146.61 4.87 0.9 Allowed 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.595 -0.944 . . . . 0.0 108.948 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.596 ' O ' HG22 ' A' ' 78' ' ' THR . 2.5 m -89.83 138.28 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.122 -0.986 . . . . 0.0 110.335 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.487 ' O ' ' N ' ' A' ' 43' ' ' GLY . 6.1 m-70 -82.0 146.12 29.88 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.025 -1.047 . . . . 0.0 108.585 178.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.456 ' C ' ' N ' ' A' ' 43' ' ' GLY . 73.7 mt -47.36 -56.5 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 120.953 -1.092 . . . . 0.0 109.896 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -54.02 -14.89 4.57 Favored Glycine 0 N--CA 1.485 1.924 0 N-CA-C 108.378 -1.889 . . . . 0.0 108.378 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.487 ' N ' ' O ' ' A' ' 40' ' ' HIS . . . -78.08 -27.49 58.06 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 108.511 -1.835 . . . . 0.0 108.511 179.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.405 ' N ' ' O ' ' A' ' 41' ' ' ILE . 2.2 t -80.18 -39.32 19.15 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 179.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.433 ' O ' HG23 ' A' ' 49' ' ' VAL . 38.6 mtm -51.39 -40.05 58.44 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 tp -62.95 -58.41 7.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.623 -0.673 . . . . 0.0 109.931 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.492 ' HB2' HD12 ' A' ' 33' ' ' LEU . 54.7 mttm -54.95 -59.75 4.31 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.425 -0.797 . . . . 0.0 111.234 -178.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.7 tp -45.51 -38.26 6.13 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 120.958 -1.089 . . . . 0.0 109.716 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.714 HG22 ' CD2' ' A' ' 58' ' ' TRP . 54.0 t -70.24 -53.93 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -45.34 -47.25 13.32 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.188 0.518 . . . . 0.0 110.975 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.593 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 7.3 mtmp? -60.85 -58.06 10.06 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 121.229 -0.919 . . . . 0.0 110.634 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.6 tp -55.52 -49.99 71.15 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.2 t70 66.05 74.96 0.35 Allowed 'General case' 0 C--N 1.299 -1.617 0 CA-C-O 121.805 0.812 . . . . 0.0 109.989 178.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.428 ' C ' ' H ' ' A' ' 56' ' ' LYS . 2.6 p -172.31 144.68 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.29 -1.999 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.979 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' CB ' ' B' ' 576' ' ' ALA . 20.6 mmtt -71.84 45.29 0.11 Allowed 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 179.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.535 ' O ' ' CD1' ' A' ' 58' ' ' TRP . 40.8 tttm -76.26 171.18 14.97 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.415 -0.803 . . . . 0.0 110.429 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 8.4 m-20 -50.89 91.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.366 -0.833 . . . . 0.0 110.357 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.714 ' CD2' HG22 ' A' ' 49' ' ' VAL . 67.7 m95 -113.55 -13.51 12.76 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-O 122.282 1.039 . . . . 0.0 109.102 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.6 t -57.39 -54.11 50.47 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-O 121.778 0.799 . . . . 0.0 109.787 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.445 ' O ' ' O ' ' A' ' 94' ' ' PRO . 54.5 t0 -91.26 12.56 19.86 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.76 -0.588 . . . . 0.0 110.684 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.46 134.77 48.09 Favored 'General case' 0 C--N 1.296 -1.753 0 O-C-N 121.124 -0.985 . . . . 0.0 110.023 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -168.74 148.52 4.36 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 63' ' ' LEU . 1.3 mm? -95.6 148.35 22.61 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.859 -1.151 . . . . 0.0 110.611 -178.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.528 ' HE1' ' CA ' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -129.94 137.65 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.5 ' O ' ' N ' ' A' ' 69' ' ' ARG . 5.2 t90 -99.7 91.67 4.97 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.528 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 16.5 pt-20 -57.51 -22.01 41.53 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.965 -1.084 . . . . 0.0 110.553 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.494 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -62.95 -13.38 34.05 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 177.762 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.444 ' N ' ' C ' ' A' ' 66' ' ' GLU . 18.9 mmtt -130.85 -12.8 3.71 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.477 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.4 mpp_? 54.11 45.9 26.52 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.997 -1.482 . . . . 0.0 106.997 -177.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.5 t -113.61 -175.42 2.67 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.647 0.737 . . . . 0.0 109.957 -178.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.467 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -125.67 102.35 7.3 Favored 'General case' 0 C--N 1.297 -1.715 0 N-CA-C 105.261 -2.126 . . . . 0.0 105.261 177.655 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.428 ' HB3' HD13 ' A' ' 41' ' ' ILE . 28.8 mt -62.01 87.01 0.02 OUTLIER 'General case' 0 C--N 1.284 -2.262 0 O-C-N 120.431 -1.418 . . . . 0.0 110.433 -176.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' A' ' 71' ' ' TRP . 3.7 pp -124.52 10.91 8.54 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.714 -0.846 . . . . 0.0 108.714 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 82.61 7.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.209 -0.932 . . . . 0.0 108.895 -179.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.417 HG21 ' O ' ' B' ' 602' ' ' LYS . 0.2 OUTLIER -75.47 -12.06 60.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.095 -1.003 . . . . 0.0 109.984 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.742 ' H ' ' CD2' ' A' ' 76' ' ' HIS . 0.6 OUTLIER -90.78 44.07 1.18 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.866 -1.147 . . . . 0.0 109.468 -179.79 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.521 ' CG ' ' O ' ' A' ' 76' ' ' HIS . 1.3 m0 -173.42 -169.87 0.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 179.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.698 ' H ' ' CG ' ' A' ' 81' ' ' LYS . 0.1 OUTLIER -139.97 -169.19 2.68 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.898 -1.126 . . . . 0.0 109.692 -179.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.533 ' N ' HD12 ' A' ' 79' ' ' LEU . 5.8 mp -65.25 -60.0 3.47 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -45.68 -52.83 10.24 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.857 0.837 . . . . 0.0 109.804 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.698 ' CG ' ' H ' ' A' ' 78' ' ' THR . 36.7 mmtt -45.43 -55.96 5.53 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-O 121.639 0.733 . . . . 0.0 109.731 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -71.28 -41.73 69.63 Favored 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 119.827 -0.749 . . . . 0.0 109.155 -179.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 120.3 11.53 6.73 Favored Glycine 0 N--CA 1.5 2.908 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.536 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 43.1 mt -71.23 160.71 5.08 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 121.606 -0.937 . . . . 0.0 109.513 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.536 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -170.76 -165.15 0.42 Allowed 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.94 -22.23 62.25 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.417 -0.802 . . . . 0.0 110.098 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -79.93 -10.0 59.73 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.157 -0.964 . . . . 0.0 108.844 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.468 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -99.93 112.83 25.09 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -93.9 115.59 27.97 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 109.964 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.5 ' HG ' HD12 ' A' ' 20' ' ' LEU . 10.4 mt -90.12 176.22 6.85 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.466 ' NE2' ' CZ2' ' A' ' 64' ' ' TRP . 1.2 mt-30 -140.63 148.93 41.64 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' A' ' 92' ' ' PHE . 0.1 OUTLIER -96.0 142.52 28.11 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 179.218 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.1 t -155.1 143.08 14.27 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . 0.445 ' O ' ' O ' ' A' ' 60' ' ' ASP . 90.3 Cg_endo . . . . . 0 N--CA 1.492 1.412 0 C-N-CA 122.036 1.824 . . . . 0.0 111.345 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . 0.471 ' C ' ' H ' ' B' ' 544' ' ' ARG . 31.5 m80 -67.66 -140.84 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.203 -0.935 . . . . 0.0 109.65 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . 0.427 ' C ' ' N ' ' B' ' 545' ' ' ARG . 10.1 pt-20 -59.5 -2.43 0.33 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.348 -0.845 . . . . 0.0 109.651 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.471 ' H ' ' C ' ' B' ' 542' ' ' HIS . 22.2 mmt180 -50.57 -13.51 0.14 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.234 -0.917 . . . . 0.0 109.577 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.427 ' N ' ' C ' ' B' ' 543' ' ' GLU . 21.6 mtp180 -66.93 -80.92 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 O-C-N 121.164 -0.96 . . . . 0.0 109.844 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -149.55 -109.36 0.49 Allowed Glycine 0 N--CA 1.496 2.657 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.54 ' O ' ' N ' ' B' ' 556' ' ' ILE . 2.0 m -166.58 118.61 0.99 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.322 -1.105 . . . . 0.0 108.047 -179.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.3 mp -59.38 135.56 57.69 Favored 'General case' 0 C--N 1.297 -1.688 0 O-C-N 120.888 -1.133 . . . . 0.0 110.653 -178.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.499 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -83.89 103.97 13.59 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 178.267 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 18.3 t -51.65 127.21 19.83 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 122.201 1.001 . . . . 0.0 109.659 -177.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.74 -34.21 5.6 Favored Glycine 0 N--CA 1.49 2.243 0 N-CA-C 106.142 -2.783 . . . . 0.0 106.142 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.1 m -106.23 -36.2 6.95 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.465 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.0 mm-40 55.72 56.37 6.21 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 122.639 1.209 . . . . 0.0 109.942 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 27.7 mmtm -140.53 124.06 10.32 Favored Pre-proline 0 N--CA 1.496 1.851 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -44.2 135.17 8.58 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 120.492 1.211 . . . . 0.0 114.855 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.54 ' N ' ' O ' ' B' ' 547' ' ' SER . 42.8 mt -94.04 99.3 9.31 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . . . . . . . . . 80.9 p -100.82 91.7 4.73 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.307 -0.871 . . . . 0.0 111.238 -177.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 154.96 -96.59 0.16 Allowed Glycine 0 N--CA 1.487 2.08 0 N-CA-C 107.334 -2.306 . . . . 0.0 107.334 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.489 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 5.3 mmt-85 -112.12 152.9 27.75 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 177.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 21.4 p -145.18 126.13 14.5 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.978 -1.076 . . . . 0.0 111.577 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 52.8 mt -90.54 146.07 6.64 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 178.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.468 ' O ' ' CE ' ' B' ' 584' ' ' LYS . 8.9 m -120.0 146.54 45.76 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 121.916 0.865 . . . . 0.0 109.283 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.723 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.19 -129.35 0.26 Allowed 'General case' 0 C--N 1.295 -1.803 0 CA-C-O 121.605 0.717 . . . . 0.0 109.406 -178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.548 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 10.1 mtt -65.66 26.02 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.688 0 O-C-N 121.617 -0.677 . . . . 0.0 109.272 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.723 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 109.46 -9.05 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -81.17 159.99 24.49 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -103.84 174.68 5.77 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -160.09 133.58 6.98 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.268 -1.373 . . . . 0.0 110.005 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.568 ' O ' ' N ' ' B' ' 571' ' ' GLU . 9.1 m80 -54.16 114.3 6.35 Favored Pre-proline 0 C--N 1.302 -1.49 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.554 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 36.8 Cg_exo -46.96 -9.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.311 -1.422 0 CA-C-N 120.331 1.154 . . . . 0.0 111.535 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.877 ' O ' HG13 ' B' ' 574' ' ' VAL . 11.9 mt-10 -98.69 -52.92 3.45 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 122.011 0.91 . . . . 0.0 110.008 179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.514 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -56.91 -4.86 0.19 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.917 -1.114 . . . . 0.0 109.87 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . 0.466 ' H ' ' C ' ' B' ' 571' ' ' GLU . 30.1 t80 -125.47 53.7 1.53 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.877 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.9 m -93.1 178.26 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 122.17 0.986 . . . . 0.0 110.487 -178.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.627 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.42 150.93 28.14 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.21 -179.499 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . 0.568 ' CB ' ' NZ ' ' A' ' 55' ' ' LYS . . . -96.24 76.85 3.03 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 117.219 -1.792 . . . . 0.0 110.031 178.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . 0.48 ' CD2' ' SG ' ' B' ' 599' ' ' CYS . 27.9 t80 -152.65 -44.38 0.1 Allowed 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 173.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . . . . . . . . . 8.2 p -137.3 125.62 23.28 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 111.71 -2.495 . . . . 0.0 106.624 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.78 13.72 0.78 Allowed 'General case' 0 C--N 1.297 -1.699 0 O-C-N 121.055 -1.028 . . . . 0.0 111.84 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.449 ' HD3' ' H ' ' B' ' 580' ' ' LYS . 0.0 OUTLIER -91.93 -39.7 11.56 Favored 'General case' 0 N--CA 1.509 2.495 0 CA-C-N 121.614 2.007 . . . . 0.0 115.204 -175.272 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.554 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.7 tp60 -162.97 141.91 8.6 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 122.377 2.353 . . . . 0.0 116.09 179.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.627 HD13 ' HB2' ' B' ' 575' ' ' CYS . 20.9 tp -140.38 168.66 19.29 Favored 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 174.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.445 ' OD1' ' O ' ' B' ' 582' ' ' LEU . 68.7 m-20 -147.67 134.98 20.62 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.066 -1.021 . . . . 0.0 109.163 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.468 ' CE ' ' O ' ' B' ' 562' ' ' THR . 11.3 ptpt -55.4 -14.13 1.77 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.73 0.776 . . . . 0.0 109.53 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -95.62 -14.97 45.04 Favored Glycine 0 N--CA 1.487 2.095 0 N-CA-C 108.797 -1.721 . . . . 0.0 108.797 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 4.6 p -136.41 26.79 3.14 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.94 -0.741 . . . . 0.0 109.083 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.575 ' HA ' HD11 ' B' ' 582' ' ' LEU . 2.8 p90 -88.25 109.39 19.9 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 122.32 1.057 . . . . 0.0 109.176 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -99.88 159.35 15.14 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.442 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 9.5 tt0 -155.24 157.25 37.0 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 122.699 1.237 . . . . 0.0 111.456 -178.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.442 ' N ' ' CG ' ' B' ' 589' ' ' GLU . 3.7 pt20 -160.9 146.19 14.33 Favored 'General case' 0 C--N 1.293 -1.863 0 N-CA-C 106.218 -1.771 . . . . 0.0 106.218 177.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.702 ' N ' ' ND2' ' B' ' 591' ' ' ASN . 0.0 OUTLIER 51.32 22.97 1.54 Allowed 'General case' 0 C--N 1.287 -2.129 0 O-C-N 121.263 -0.898 . . . . 0.0 109.155 -178.572 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.47 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.3 m-20 81.57 -7.07 1.47 Allowed 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.775 -0.578 . . . . 0.0 111.819 178.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -87.83 116.12 65.18 Favored Pre-proline 0 C--N 1.294 -1.845 0 O-C-N 120.948 -1.095 . . . . 0.0 110.643 -178.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.524 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 34.6 Cg_exo -53.05 164.31 1.75 Allowed 'Trans proline' 0 N--CA 1.491 1.372 0 CA-C-N 119.883 0.994 . . . . 0.0 112.147 178.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.524 ' CG ' ' O ' ' B' ' 594' ' ' PRO . 25.0 m-85 -171.04 139.91 1.46 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.287 -0.883 . . . . 0.0 110.229 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 8.0 m -69.53 155.14 40.96 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 103.529 -2.767 . . . . 0.0 103.529 174.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.598 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -59.15 -55.91 28.95 Favored 'General case' 0 C--N 1.292 -1.911 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.062 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -46.35 -26.97 0.92 Allowed 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.682 -0.636 . . . . 0.0 109.455 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' B' ' 577' ' ' PHE . 23.2 m -84.8 -60.23 2.12 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.479 ' CD2' ' N ' ' B' ' 601' ' ' LEU . 0.6 OUTLIER -55.76 -54.66 41.68 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.605 -0.684 . . . . 0.0 109.273 179.903 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.652 ' C ' HD12 ' B' ' 601' ' ' LEU . 0.1 OUTLIER -48.71 -41.79 32.99 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.628 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.417 ' O ' HG21 ' A' ' 75' ' ' THR . 0.4 OUTLIER -52.78 -26.95 15.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 109.016 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . . . . . . . . . 2.3 mt -92.68 -57.25 2.73 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.195 -0.941 . . . . 0.0 111.25 -177.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.409 ' O ' ' O ' ' B' ' 605' ' ' CYS . 11.6 m-85 -102.08 32.13 3.62 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.318 -0.864 . . . . 0.0 110.022 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.409 ' O ' ' O ' ' B' ' 604' ' ' PHE . 9.5 t . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 117.923 -1.037 . . . . 0.0 109.713 179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ttt . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 3' ' ' LEU . . . -172.78 -34.09 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.294 -0.879 . . . . 0.0 109.639 -179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.482 ' O ' ' N ' ' A' ' 5' ' ' GLY . 74.9 mt -40.29 -81.07 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 CA-C-O 122.058 0.933 . . . . 0.0 109.794 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 18.0 t70 42.65 23.86 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.803 0 CA-C-O 121.949 0.88 . . . . 0.0 109.33 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 3' ' ' LEU . . . -65.89 -12.83 58.22 Favored Glycine 0 N--CA 1.486 1.995 0 N-CA-C 108.448 -1.861 . . . . 0.0 108.448 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.682 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -111.37 -104.03 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.709 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -179.069 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.6 ' CG ' ' H ' ' A' ' 8' ' ' MET . 0.0 OUTLIER -160.96 -102.62 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.168 0 O-C-N 120.588 -1.32 . . . . 0.0 109.985 -179.45 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.6 ' H ' ' CG ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -146.72 -64.01 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.17 -0.957 . . . . 0.0 110.288 -179.297 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.44 -34.21 14.1 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 CA-C-N 121.483 1.565 . . . . 0.0 109.789 178.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -106.66 -29.41 9.62 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -84.36 4.92 82.75 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.585 ' SG ' ' N ' ' A' ' 13' ' ' TYR . 2.1 t 178.19 -91.84 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.964 -0.727 . . . . 0.0 109.242 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.641 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 0.4 OUTLIER 167.75 -51.35 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 -179.485 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.641 ' HB2' ' O ' ' A' ' 13' ' ' TYR . . . 161.39 -45.23 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -160.09 3.08 0.08 Allowed 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.726 -0.609 . . . . 0.0 109.774 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.492 ' O ' ' CE2' ' A' ' 18' ' ' TRP . . . 78.49 36.83 28.98 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 p -85.67 122.86 30.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.611 -0.934 . . . . 0.0 110.427 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.492 ' CE2' ' O ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -137.81 122.52 18.69 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 178.788 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.617 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -77.74 130.11 36.34 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.225 -0.922 . . . . 0.0 108.717 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.491 ' CD1' ' O ' ' A' ' 88' ' ' ALA . 0.1 OUTLIER -83.6 133.7 34.83 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -78.2 145.5 35.53 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.242 -0.911 . . . . 0.0 109.62 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 37.5 t -138.16 106.25 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-O 121.9 0.857 . . . . 0.0 109.683 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -80.62 103.71 10.66 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.577 ' O ' ' N ' ' A' ' 28' ' ' ASN . 1.2 t -72.41 103.48 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.516 ' O ' ' N ' ' A' ' 27' ' ' LEU . 4.1 p -69.03 -65.55 0.69 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 110.89 -177.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' N ' ' OG1' ' A' ' 25' ' ' THR . 25.7 t70 -49.35 -9.25 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.047 -1.033 . . . . 0.0 110.393 -179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 25' ' ' THR . 2.2 mt -120.86 -23.76 5.83 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.383 -0.823 . . . . 0.0 108.941 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 24' ' ' VAL . 0.3 OUTLIER 74.27 13.92 3.82 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 122.143 -0.348 . . . . 0.0 110.406 -179.868 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.425 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 56.6 mtp85 -97.25 -178.53 4.2 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.925 -1.11 . . . . 0.0 109.791 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 29' ' ' ARG . 83.7 m-20 -138.39 118.24 13.26 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 178.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' N ' ' A' ' 32' ' ' THR . 16.6 t -120.47 157.9 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 CA-C-O 121.557 0.694 . . . . 0.0 109.629 -179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.445 ' C ' HD22 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -133.11 136.63 45.94 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.445 HD22 ' C ' ' A' ' 32' ' ' THR . 3.2 mm? -114.46 113.04 23.94 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -60.28 101.97 0.15 Allowed 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 179.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 25.9 m -132.59 -174.9 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 CA-C-O 121.925 0.869 . . . . 0.0 110.316 -178.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.7 p -141.11 175.56 9.53 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.59 49.02 3.3 Favored Glycine 0 C--N 1.292 -1.882 0 N-CA-C 108.128 -1.989 . . . . 0.0 108.128 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.406 ' HA ' HG21 ' A' ' 78' ' ' THR . 0.7 OUTLIER -145.72 -4.65 0.66 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.44 -1.036 . . . . 0.0 109.021 -179.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.531 ' O ' HG22 ' A' ' 78' ' ' THR . 1.2 m -87.5 150.29 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.162 -0.961 . . . . 0.0 110.455 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.3 138.72 31.31 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.517 HD13 ' HB3' ' A' ' 72' ' ' LEU . 38.7 mt -50.58 -49.03 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.953 -1.092 . . . . 0.0 108.499 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.509 ' H ' ' HB ' ' A' ' 75' ' ' THR . . . -53.49 -13.76 3.04 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 108.287 -1.925 . . . . 0.0 108.287 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.468 ' N ' ' C ' ' A' ' 41' ' ' ILE . . . -79.67 -38.56 20.08 Favored Glycine 0 N--CA 1.482 1.704 0 N-CA-C 108.155 -1.978 . . . . 0.0 108.155 179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.61 -43.21 94.05 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 45.4 mtm -50.95 -32.78 21.98 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tp -77.94 -64.06 1.24 Allowed 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.228 0.537 . . . . 0.0 109.939 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mttm -51.63 -59.38 4.34 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.193 -0.942 . . . . 0.0 110.863 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.82 -55.25 5.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.151 -0.968 . . . . 0.0 108.78 -179.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.412 HG13 ' CE2' ' A' ' 58' ' ' TRP . 14.2 t -56.81 -52.42 54.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.78 0 O-C-N 121.839 -0.538 . . . . 0.0 109.589 179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -44.55 -40.51 5.75 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.204 -0.935 . . . . 0.0 110.159 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.471 ' NZ ' ' CB ' ' A' ' 51' ' ' LYS . 8.1 mtmp? -71.66 -27.9 63.38 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.618 HD21 ' NZ ' ' A' ' 56' ' ' LYS . 7.2 tp -65.75 -58.63 5.21 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.186 -0.946 . . . . 0.0 109.031 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t0 69.17 72.06 0.26 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.765 0.793 . . . . 0.0 110.698 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.528 ' C ' ' H ' ' A' ' 56' ' ' LYS . 3.1 p -175.25 138.62 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -66.96 34.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.13 -0.981 . . . . 0.0 109.641 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.618 ' NZ ' HD21 ' A' ' 52' ' ' LEU . 6.6 ttpm? -78.03 168.81 19.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.041 -1.037 . . . . 0.0 109.469 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.457 ' N ' ' CG ' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -50.17 109.36 0.29 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.41 -0.806 . . . . 0.0 109.455 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.616 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 44.3 m0 -103.83 -89.47 0.4 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.543 ' O ' ' N ' ' A' ' 61' ' ' HIS . 4.9 t -43.6 -48.21 7.59 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.17 -0.956 . . . . 0.0 110.492 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' SER . 9.0 t0 -43.7 -19.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.616 ' ND1' ' O ' ' A' ' 58' ' ' TRP . 1.6 p-80 -88.52 167.52 13.36 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 122.021 0.915 . . . . 0.0 109.821 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -169.54 153.12 4.97 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.841 HD22 ' N ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -94.07 147.16 23.4 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.973 -1.08 . . . . 0.0 109.288 -179.525 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.525 ' C ' ' CD1' ' A' ' 64' ' ' TRP . 0.0 OUTLIER -133.27 137.02 45.86 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.719 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 69' ' ' ARG . 4.9 t90 -96.46 91.28 5.73 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 -179.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.477 ' CA ' ' HE1' ' A' ' 64' ' ' TRP . 13.3 pt-20 -57.16 -21.99 36.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.806 -1.184 . . . . 0.0 110.197 -178.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 67' ' ' LYS . 0.3 OUTLIER -62.16 -15.3 45.14 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 177.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.461 ' N ' ' C ' ' A' ' 66' ' ' GLU . 16.7 mmtt -130.3 -12.56 4.01 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.755 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.516 ' N ' ' O ' ' A' ' 65' ' ' TRP . 2.2 mpp_? 54.42 45.96 26.0 Favored 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 -177.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.7 t -114.36 -173.29 2.26 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 121.443 0.639 . . . . 0.0 110.237 -178.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.425 ' O ' ' N ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -123.95 102.95 8.04 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 105.277 -2.12 . . . . 0.0 105.277 177.557 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.517 ' HB3' HD13 ' A' ' 41' ' ' ILE . 25.1 mt -63.15 88.75 0.03 OUTLIER 'General case' 0 C--N 1.284 -2.269 0 O-C-N 120.367 -1.458 . . . . 0.0 110.617 -176.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.539 ' H ' ' HE3' ' A' ' 74' ' ' LYS . 3.1 pp -120.78 10.1 10.86 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.539 ' HE3' ' H ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -72.22 38.62 0.07 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.134 -0.979 . . . . 0.0 110.846 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.509 ' HB ' ' H ' ' A' ' 42' ' ' GLY . 0.2 OUTLIER -55.65 -6.84 0.22 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.287 -1.508 . . . . 0.0 108.704 179.477 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.498 ' H ' ' C ' ' A' ' 74' ' ' LYS . 16.1 t60 -59.86 -77.05 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 110.035 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -82.34 -118.7 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.098 -1.001 . . . . 0.0 109.647 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.531 HG22 ' O ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -153.75 150.56 28.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.642 -1.286 . . . . 0.0 109.757 -179.464 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.66 HD23 ' N ' ' A' ' 79' ' ' LEU . 1.5 pt? -43.86 -47.6 8.25 Favored 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.064 -1.022 . . . . 0.0 110.021 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.444 ' N ' ' HG ' ' A' ' 79' ' ' LEU . 7.2 t70 -47.38 -34.17 6.72 Favored 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.312 -0.867 . . . . 0.0 109.518 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.519 ' HD3' ' N ' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -67.1 -30.34 70.33 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 106.897 -1.519 . . . . 0.0 106.897 -179.44 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 79' ' ' LEU . 1.1 t80 -81.37 -49.62 10.46 Favored 'General case' 0 C--N 1.296 -1.72 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 122.82 9.4 6.29 Favored Glycine 0 N--CA 1.512 3.754 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.541 ' O ' ' NE2' ' A' ' 85' ' ' GLN . 47.0 mt -60.87 161.73 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.028 0 O-C-N 122.075 -0.662 . . . . 0.0 109.242 179.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.541 ' NE2' ' O ' ' A' ' 84' ' ' ILE . 0.0 OUTLIER -164.39 -168.28 1.49 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.243 -0.91 . . . . 0.0 109.438 179.356 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.64 -26.55 67.12 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 121.294 -0.879 . . . . 0.0 109.896 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -76.79 -10.09 59.13 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.491 ' O ' ' CD1' ' A' ' 20' ' ' LEU . . . -94.13 112.32 24.13 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.4 mmtp -97.54 117.29 31.49 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.944 -1.098 . . . . 0.0 109.837 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.487 ' HG ' HD12 ' A' ' 20' ' ' LEU . 5.2 mt -95.64 175.62 6.47 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.41 ' NE2' ' CH2' ' A' ' 64' ' ' TRP . 8.1 mt-30 -134.08 161.56 34.51 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.575 ' CE2' ' CG ' ' A' ' 61' ' ' HIS . 3.4 t80 -122.94 125.62 45.66 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 178.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.1 t -140.35 148.2 52.91 Favored Pre-proline 0 N--CA 1.498 1.964 0 O-C-N 121.36 -0.837 . . . . 0.0 108.866 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo . . . . . 0 N--CA 1.496 1.668 0 C-N-CA 122.315 2.01 . . . . 0.0 111.936 -179.668 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 541' ' ' TYR . . . . . . . . . . . . . 41.1 t80 . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.266 0.555 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 542' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -154.8 -73.35 0.12 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.167 -0.958 . . . . 0.0 109.127 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 543' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -121.05 -7.97 9.37 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.625 -0.672 . . . . 0.0 109.391 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 544' ' ' ARG . . . . . 0.519 ' HG2' HH21 ' B' ' 544' ' ' ARG . 1.2 mmt-85 -50.55 -46.96 57.82 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.192 -0.942 . . . . 0.0 109.226 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 545' ' ' ARG . . . . . 0.434 ' O ' ' O ' ' B' ' 544' ' ' ARG . 11.9 mpt_? -57.06 -111.52 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.3 0 O-C-N 121.364 -0.835 . . . . 0.0 110.109 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 546' ' ' GLY . . . . . . . . . . . . . . . -129.67 -83.5 0.33 Allowed Glycine 0 N--CA 1.502 3.041 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . 0.556 ' O ' ' N ' ' B' ' 556' ' ' ILE . 1.9 m -171.44 120.94 0.5 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.109 -1.23 . . . . 0.0 108.331 -178.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 548' ' ' LEU . . . . . . . . . . . . . 5.4 mp -58.93 135.84 57.7 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 120.77 -1.206 . . . . 0.0 110.828 -178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 549' ' ' CYS . . . . . 0.503 ' HA ' HD11 ' B' ' 556' ' ' ILE . 0.7 OUTLIER -84.14 104.13 13.93 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 105.929 -1.878 . . . . 0.0 105.929 178.073 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.2 t -51.77 127.06 19.68 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 122.137 0.97 . . . . 0.0 109.599 -177.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 551' ' ' GLY . . . . . . . . . . . . . . . 109.84 -33.24 6.15 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 106.199 -2.76 . . . . 0.0 106.199 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 552' ' ' CYS . . . . . . . . . . . . . 8.4 m -107.65 -35.94 6.57 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 553' ' ' GLN . . . . . 0.461 ' HA ' ' NE2' ' B' ' 553' ' ' GLN . 18.6 mm-40 55.58 56.38 6.29 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 122.61 1.195 . . . . 0.0 110.038 -178.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 554' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -140.62 124.08 10.24 Favored Pre-proline 0 C--N 1.293 -1.863 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 555' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -44.05 136.02 7.84 Favored 'Trans proline' 0 N--CA 1.494 1.526 0 CA-C-N 120.441 1.193 . . . . 0.0 115.113 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 556' ' ' ILE . . . . . 0.556 ' N ' ' O ' ' B' ' 547' ' ' SER . 44.7 mt -95.35 97.97 7.37 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.309 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 557' ' ' THR . . . . . 0.423 ' O ' ' OG1' ' B' ' 557' ' ' THR . 6.2 p -100.07 91.37 4.75 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.227 -0.92 . . . . 0.0 111.279 -177.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 558' ' ' GLY . . . . . . . . . . . . . . . 156.3 -95.18 0.15 Allowed Glycine 0 N--CA 1.488 2.117 0 N-CA-C 107.532 -2.227 . . . . 0.0 107.532 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 559' ' ' ARG . . . . . 0.482 ' O ' ' CG2' ' B' ' 556' ' ' ILE . 3.0 mmt-85 -114.04 152.71 30.59 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 178.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 560' ' ' CYS . . . . . . . . . . . . . 18.6 p -144.63 126.25 15.09 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.947 -1.096 . . . . 0.0 111.605 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 561' ' ' ILE . . . . . . . . . . . . . 47.7 mt -90.74 146.48 6.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 562' ' ' THR . . . . . 0.759 ' H ' ' HZ1' ' B' ' 584' ' ' LYS . 7.1 m -118.2 147.29 43.53 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-O 121.834 0.826 . . . . 0.0 109.226 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 563' ' ' ALA . . . . . 0.747 ' C ' ' H ' ' B' ' 565' ' ' ALA . . . -123.94 -129.08 0.25 Allowed 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.563 0.697 . . . . 0.0 109.495 -178.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 564' ' ' MET . . . . . 0.561 ' O ' ' CB ' ' B' ' 565' ' ' ALA . 9.7 mtp -65.66 26.3 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 565' ' ' ALA . . . . . 0.747 ' H ' ' C ' ' B' ' 563' ' ' ALA . . . 108.95 -9.07 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 106.414 -1.699 . . . . 0.0 106.414 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 566' ' ' LYS . . . . . . . . . . . . . 13.4 mtmt -81.3 163.14 23.14 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 567' ' ' LYS . . . . . 0.508 ' O ' ' CD1' ' B' ' 568' ' ' PHE . 18.6 mmmt -104.8 174.56 5.83 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 568' ' ' PHE . . . . . 0.508 ' CD1' ' O ' ' B' ' 567' ' ' LYS . 2.9 m-85 -159.81 132.01 6.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.526 -1.359 . . . . 0.0 110.219 -178.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 569' ' ' HIS . . . . . 0.543 ' ND1' ' CE1' ' B' ' 572' ' ' HIS . 9.0 m80 -53.3 113.4 4.68 Favored Pre-proline 0 C--N 1.305 -1.347 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 176.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 570' ' ' PRO . . . . . 0.602 ' O ' ' NE2' ' B' ' 581' ' ' GLN . 31.2 Cg_exo -47.66 -13.26 0.17 Allowed 'Trans proline' 0 C--N 1.308 -1.586 0 CA-C-N 120.426 1.188 . . . . 0.0 110.802 -178.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 571' ' ' GLU . . . . . 0.867 ' O ' HG13 ' B' ' 574' ' ' VAL . 5.9 mt-10 -92.22 -52.19 4.81 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 122.079 0.943 . . . . 0.0 110.359 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 572' ' ' HIS . . . . . 0.543 ' CE1' ' ND1' ' B' ' 569' ' ' HIS . 17.9 m170 -59.93 -5.67 1.06 Allowed 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.086 -1.009 . . . . 0.0 110.046 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 573' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -127.72 56.01 1.6 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 574' ' ' VAL . . . . . 0.867 HG13 ' O ' ' B' ' 571' ' ' GLU . 16.2 m -94.85 177.27 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 CA-C-O 121.765 0.793 . . . . 0.0 111.448 -178.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 575' ' ' CYS . . . . . 0.599 ' HB2' HD13 ' B' ' 582' ' ' LEU . 0.0 OUTLIER -81.63 143.02 32.22 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 178.599 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 576' ' ' ALA . . . . . . . . . . . . . . . -91.12 73.12 6.33 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 116.065 -2.254 . . . . 0.0 108.703 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 577' ' ' PHE . . . . . 0.416 ' O ' ' N ' ' A' ' 59' ' ' SER . 0.4 OUTLIER -157.52 -36.95 0.07 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 173.883 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 578' ' ' CYS . . . . . 0.584 ' O ' ' N ' ' B' ' 580' ' ' LYS . 29.8 p -137.12 82.43 1.93 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 178.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 579' ' ' LEU . . . . . 0.849 HD13 ' H ' ' B' ' 579' ' ' LEU . 0.0 OUTLIER -51.46 13.96 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -176.493 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 580' ' ' LYS . . . . . 0.584 ' N ' ' O ' ' B' ' 578' ' ' CYS . 0.0 OUTLIER -96.05 -38.3 10.26 Favored 'General case' 0 N--CA 1.505 2.323 0 CA-C-N 121.369 1.895 . . . . 0.0 113.024 -178.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 581' ' ' GLN . . . . . 0.602 ' NE2' ' O ' ' B' ' 570' ' ' PRO . 5.6 tp60 -160.64 140.2 10.85 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 119.47 -2.019 . . . . 0.0 115.652 179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 582' ' ' LEU . . . . . 0.599 HD13 ' HB2' ' B' ' 575' ' ' CYS . 23.2 tp -135.07 170.1 16.42 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 583' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' B' ' 587' ' ' PHE . 79.2 m-20 -144.8 129.23 17.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.051 -1.031 . . . . 0.0 109.261 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 584' ' ' LYS . . . . . 0.759 ' HZ1' ' H ' ' B' ' 562' ' ' THR . 0.3 OUTLIER -53.85 -16.17 1.66 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.418 -0.801 . . . . 0.0 109.514 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 585' ' ' GLY . . . . . . . . . . . . . . . -89.88 -17.76 53.07 Favored Glycine 0 N--CA 1.486 1.98 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 -179.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 586' ' ' THR . . . . . . . . . . . . . 3.8 p -135.63 28.94 3.26 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 587' ' ' PHE . . . . . 0.573 ' CG ' ' O ' ' B' ' 587' ' ' PHE . 1.1 p90 -88.93 106.1 18.19 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 122.762 1.268 . . . . 0.0 109.738 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 588' ' ' LYS . . . . . 0.53 ' N ' ' O ' ' B' ' 595' ' ' TYR . 0.0 OUTLIER -98.05 167.66 10.75 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 589' ' ' GLU . . . . . 0.445 ' CG ' ' N ' ' B' ' 590' ' ' GLN . 10.7 tt0 -152.07 156.96 40.95 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-O 122.679 1.228 . . . . 0.0 110.593 -179.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 590' ' ' GLN . . . . . 0.562 ' CG ' ' ND2' ' B' ' 591' ' ' ASN . 1.8 tp60 -158.59 146.47 18.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 178.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 591' ' ' ASN . . . . . 0.562 ' ND2' ' CG ' ' B' ' 590' ' ' GLN . 0.0 OUTLIER 47.1 22.37 0.22 Allowed 'General case' 0 C--N 1.296 -1.746 0 O-C-N 121.008 -1.057 . . . . 0.0 109.906 -179.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 592' ' ' ASP . . . . . 0.476 ' CB ' ' O ' ' B' ' 591' ' ' ASN . 2.6 m-20 81.07 -3.96 1.72 Allowed 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.664 -0.648 . . . . 0.0 111.149 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 593' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -89.6 123.57 66.28 Favored Pre-proline 0 C--N 1.292 -1.932 0 O-C-N 121.116 -0.99 . . . . 0.0 109.125 -179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 594' ' ' PRO . . . . . 0.494 ' O ' ' CG ' ' B' ' 595' ' ' TYR . 45.8 Cg_exo -48.26 165.44 0.15 Allowed 'Trans proline' 0 N--CA 1.485 1.026 0 CA-C-N 120.301 1.143 . . . . 0.0 110.923 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 595' ' ' TYR . . . . . 0.53 ' O ' ' N ' ' B' ' 588' ' ' LYS . 9.1 m-85 -170.3 141.1 1.97 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.734 -1.229 . . . . 0.0 111.204 -178.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 596' ' ' CYS . . . . . . . . . . . . . 26.4 m -78.63 154.2 30.44 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 104.627 -2.36 . . . . 0.0 104.627 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 597' ' ' GLN . . . . . 0.606 ' HA ' HE21 ' B' ' 597' ' ' GLN . 0.0 OUTLIER -61.44 -56.5 19.47 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.328 -1.73 . . . . 0.0 106.328 178.763 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 598' ' ' ASN . . . . . 0.59 ' HA ' HD22 ' B' ' 601' ' ' LEU . 1.4 m120 -44.97 -33.85 2.19 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.63 0.729 . . . . 0.0 109.741 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 599' ' ' CYS . . . . . . . . . . . . . 68.0 m -78.66 -62.85 1.56 Allowed 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.419 -0.801 . . . . 0.0 110.015 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 600' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' B' ' 601' ' ' LEU . 0.0 OUTLIER -57.78 -47.57 82.15 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 122.102 -0.374 . . . . 0.0 111.937 -178.17 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 601' ' ' LEU . . . . . 0.98 HD23 ' H ' ' B' ' 602' ' ' LYS . 0.0 OUTLIER -56.28 -51.4 68.31 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 120.721 -1.237 . . . . 0.0 108.438 -177.892 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 602' ' ' LYS . . . . . 0.98 ' H ' HD23 ' B' ' 601' ' ' LEU . 18.5 tttt -45.56 -24.93 0.38 Allowed 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.389 -0.82 . . . . 0.0 109.972 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 603' ' ' LEU . . . . . 0.452 HD23 ' N ' ' B' ' 603' ' ' LEU . 0.3 OUTLIER -95.91 -57.03 2.47 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.078 -1.014 . . . . 0.0 111.161 -178.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 604' ' ' PHE . . . . . 0.501 ' O ' ' SG ' ' B' ' 605' ' ' CYS . 37.8 m-85 -97.92 22.42 9.29 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.153 -0.967 . . . . 0.0 110.336 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 605' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' B' ' 604' ' ' PHE . 58.2 m . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 118.067 -0.968 . . . . 0.0 109.343 179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_