data_1mvi_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1mvi _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.43 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.52 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.402 ' C ' ' H ' ' A' ' 14' ' ' ASP . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 12' ' ' MET . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.455 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m . . . . . 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -108.58 144.34 36.41 Favored 'General case' 0 N--CA 1.501 2.088 0 CA-C-O 121.459 0.647 . . . . 0.0 112.559 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -90.91 176.82 41.23 Favored Glycine 0 N--CA 1.496 2.668 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.383 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.8 mmtt -60.44 132.53 54.21 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.473 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.36 16.54 79.35 Favored Glycine 0 N--CA 1.493 2.47 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.563 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.65 161.31 19.31 Favored 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.49 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.8 tttt -77.0 80.69 3.53 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.946 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -79.91 -159.94 0.24 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.361 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.44 139.43 10.54 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.688 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -26.97 67.99 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.396 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.43 -13.47 23.13 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.903 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mmm -141.75 91.74 2.39 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 124.087 0.867 . . . . 0.0 108.699 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -81.56 62.46 5.43 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.185 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.63 -18.45 30.58 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 113.966 -1.47 . . . . 0.0 113.402 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.3 m -51.58 138.32 22.86 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 124.26 0.975 . . . . 0.0 111.407 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 m -54.69 -45.96 74.05 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 114.305 -1.316 . . . . 0.0 112.38 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 m -108.66 37.57 2.49 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.077 -1.42 . . . . 0.0 111.041 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.8 45.64 1.56 Allowed Glycine 0 N--CA 1.503 3.162 0 CA-C-N 114.642 -1.163 . . . . 0.0 112.182 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -14.12 59.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 113.96 -1.12 . . . . 0.0 112.841 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -31.86 130.01 0.16 Allowed 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -126.44 64.31 1.26 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.594 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m 47.25 34.92 3.37 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 112.641 -2.072 . . . . 0.0 112.314 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -23.01 2.63 Favored Glycine 0 N--CA 1.493 2.485 0 CA-C-N 113.791 -1.55 . . . . 0.0 113.119 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -122.46 120.6 34.39 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.867 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.501 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 50.9 m . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 122.622 1.201 . . . . 0.0 111.463 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.8 p . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -112.26 137.91 49.71 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-O 121.524 0.678 . . . . 0.0 112.607 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.0 -170.88 46.68 Favored Glycine 0 N--CA 1.498 2.787 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.62 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -59.13 135.14 57.54 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.93 12.53 43.26 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.833 -1.076 . . . . 0.0 113.225 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.57 153.61 42.71 Favored 'General case' 0 N--CA 1.496 1.875 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.778 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -65.74 91.07 0.13 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 123.937 0.773 . . . . 0.0 111.121 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -92.89 -167.46 1.74 Allowed 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.128 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -160.25 143.01 13.39 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.466 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -64.29 -26.61 68.56 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.986 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 tp -95.96 -8.92 32.49 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.108 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.7 mtm -142.14 92.4 2.43 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -80.13 60.46 3.65 Favored 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 113.205 -1.816 . . . . 0.0 108.704 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -57.21 -27.97 62.46 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.638 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.0 m -49.74 136.28 17.83 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.462 1.101 . . . . 0.0 111.842 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -53.73 -43.78 69.34 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.26 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 m -114.8 39.7 2.79 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 114.039 -1.437 . . . . 0.0 111.309 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.9 45.48 1.6 Allowed Glycine 0 N--CA 1.506 3.334 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.717 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -11.63 59.88 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.055 -1.073 . . . . 0.0 113.488 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -28.58 133.04 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 116.042 1.868 . . . . 0.0 116.042 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 ttm105 -132.65 60.19 1.7 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 113.139 -1.846 . . . . 0.0 106.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.8 p 42.7 39.63 1.72 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-N 112.705 -2.043 . . . . 0.0 112.546 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.08 -18.5 2.71 Favored Glycine 0 N--CA 1.493 2.453 0 CA-C-N 112.605 -2.089 . . . . 0.0 112.827 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -130.36 121.98 27.01 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.28 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 30.7 m . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 122.387 1.089 . . . . 0.0 111.117 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.6 p . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -127.03 148.73 50.11 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -94.95 171.63 30.19 Favored Glycine 0 N--CA 1.494 2.507 0 CA-C-N 113.93 -1.486 . . . . 0.0 110.818 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -52.48 137.85 28.95 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 114.61 -0.795 . . . . 0.0 111.875 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.57 12.29 84.39 Favored Glycine 0 N--CA 1.492 2.407 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.665 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.18 167.15 11.54 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.366 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -76.47 86.63 3.2 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.884 0.85 . . . . 0.0 110.167 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.569 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 7.1 p -86.2 -170.81 3.26 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 114.163 -1.38 . . . . 0.0 112.857 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -159.95 125.22 4.02 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.89 -1.504 . . . . 0.0 107.843 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.4 -7.8 54.13 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.024 -1.444 . . . . 0.0 110.881 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.5 tp -95.21 -22.42 17.83 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.533 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' N ' ' A' ' 14' ' ' ASP . 69.5 mmm -144.36 42.37 1.39 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 123.863 0.727 . . . . 0.0 110.879 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -8.35 66.94 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 125.977 1.711 . . . . 0.0 115.017 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.3 t70 -50.45 -32.05 16.86 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 110.779 -2.919 . . . . 0.0 112.455 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 6.9 m -62.84 143.21 57.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.84 1.338 . . . . 0.0 111.015 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -57.33 -46.4 83.3 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.235 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.8 m -103.91 32.44 3.93 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.192 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 33.85 43.58 0.3 Allowed Glycine 0 N--CA 1.507 3.427 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.249 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.7 -13.06 59.74 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -21.1 125.56 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 117.349 2.352 . . . . 0.0 117.349 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -113.85 66.72 0.67 Allowed 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.265 -1.789 . . . . 0.0 107.008 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.2 t 50.38 29.45 3.87 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 113.281 -1.781 . . . . 0.0 113.037 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.5 -19.97 2.78 Favored Glycine 0 N--CA 1.497 2.701 0 CA-C-N 114.539 -1.209 . . . . 0.0 113.083 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -121.56 116.0 23.83 Favored 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.6 m . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 122.509 1.147 . . . . 0.0 113.343 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.3 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.9 mptt -111.57 131.9 54.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 123.82 0.7 . . . . 0.0 111.405 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.02 175.31 54.6 Favored Glycine 0 N--CA 1.496 2.676 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.041 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -58.05 142.79 45.68 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.082 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.0 12.09 64.55 Favored Glycine 0 N--CA 1.493 2.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.372 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.22 158.28 23.61 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.041 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 tptt -74.81 83.22 2.14 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.75 -164.73 0.83 Allowed 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.602 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.07 127.85 4.67 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.092 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -15.83 62.94 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-N 113.497 -1.683 . . . . 0.0 112.208 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.6 -8.1 58.97 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.609 -0.836 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -163.74 38.42 0.09 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -4.74 63.88 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.917 0 O-C-N 125.76 1.913 . . . . 0.0 114.177 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.528 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.8 p30 -57.86 -17.59 17.29 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.279 -2.691 . . . . 0.0 115.054 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 45.2 m -58.15 144.15 41.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 124.24 0.963 . . . . 0.0 110.751 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.1 m -53.51 -45.41 69.71 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.608 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 m -110.3 37.5 2.7 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 125.059 1.474 . . . . 0.0 110.723 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.73 39.84 1.97 Allowed Glycine 0 N--CA 1.503 3.134 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.727 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.45 -13.75 59.37 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.671 -1.264 . . . . 0.0 112.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.446 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 17.8 t -35.4 120.62 0.56 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.899 1.374 . . . . 0.0 114.049 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -117.02 65.89 0.72 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.145 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 m 48.78 31.21 2.98 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 112.792 -2.003 . . . . 0.0 112.835 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -20.14 2.72 Favored Glycine 0 N--CA 1.496 2.647 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.422 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -123.21 118.39 27.5 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.49 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 34.2 m . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 122.677 1.227 . . . . 0.0 111.807 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.8 mttm -108.12 143.96 36.15 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-O 121.474 0.654 . . . . 0.0 112.247 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.76 -178.13 40.9 Favored Glycine 0 N--CA 1.496 2.681 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.273 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -57.78 135.3 56.79 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.4 14.74 72.15 Favored Glycine 0 N--CA 1.495 2.591 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.833 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.35 155.53 28.39 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.97 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.73 82.16 1.15 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.726 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.523 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.9 p -80.71 -163.46 0.58 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.631 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 140.71 11.74 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.34 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -66.56 -24.51 66.37 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.276 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -95.39 -12.2 26.4 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 114.827 -1.078 . . . . 0.0 110.28 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 66.8 mtm -142.61 90.85 2.26 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 124.393 1.058 . . . . 0.0 108.214 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.415 ' CE2' ' HB3' ' A' ' 20' ' ' CYS . 6.2 m-85 -80.01 62.54 4.24 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-N 113.627 -1.624 . . . . 0.0 107.406 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -59.01 -22.9 61.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.622 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.9 m -51.91 137.88 25.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 124.327 1.017 . . . . 0.0 110.717 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -53.47 -45.37 69.53 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.809 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -108.51 34.14 3.8 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.815 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.45 45.6 1.37 Allowed Glycine 0 N--CA 1.505 3.26 0 CA-C-N 114.294 -1.321 . . . . 0.0 112.438 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.47 -13.63 59.44 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 12.1 t -28.68 130.42 0.06 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -125.52 65.91 1.16 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.082 -1.821 . . . . 0.0 106.082 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.4 m 47.55 34.39 3.5 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 112.688 -2.051 . . . . 0.0 112.36 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.77 -21.37 2.69 Favored Glycine 0 N--CA 1.493 2.5 0 CA-C-N 113.75 -1.568 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -123.31 120.15 32.22 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 118.111 0.955 . . . . 0.0 109.654 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.523 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 41.1 m . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 122.501 1.143 . . . . 0.0 111.714 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mmtm -123.52 145.29 48.98 Favored 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.912 0.863 . . . . 0.0 112.654 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.56 166.48 53.4 Favored Glycine 0 N--CA 1.495 2.608 0 CA-C-N 113.52 -1.673 . . . . 0.0 111.457 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.08 127.21 30.68 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 115.135 -0.533 . . . . 0.0 111.884 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.97 8.37 69.27 Favored Glycine 0 N--CA 1.494 2.533 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.001 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.9 162.42 16.13 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.066 0.46 . . . . 0.0 110.697 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -63.87 90.79 0.06 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.333 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.484 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 1.5 p -88.9 -172.02 3.53 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.793 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 128.59 4.75 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.748 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.3 mtm180 -73.3 -12.65 60.92 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.874 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 pp -91.66 -12.19 34.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 124.038 0.836 . . . . 0.0 110.445 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 14' ' ' ASP . 22.9 ptm -156.87 38.57 0.31 Allowed 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -5.35 64.39 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 126.23 1.812 . . . . 0.0 115.749 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 12' ' ' MET . 3.4 t0 -53.11 -31.97 44.9 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.128 -2.305 . . . . 0.0 112.145 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.484 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 25.6 m -52.76 134.91 36.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 124.334 1.021 . . . . 0.0 112.149 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.5 m -55.87 -45.52 78.49 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-N 114.206 -1.361 . . . . 0.0 112.28 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 m -108.01 36.47 2.77 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 124.784 1.303 . . . . 0.0 111.065 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.78 43.23 1.19 Allowed Glycine 0 N--CA 1.505 3.267 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.608 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.61 -14.41 58.83 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.4 t -25.08 113.29 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.42 67.77 0.65 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.602 -1.636 . . . . 0.0 107.538 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 t 50.05 28.77 3.13 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 112.361 -2.199 . . . . 0.0 113.247 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.42 -16.87 2.9 Favored Glycine 0 N--CA 1.495 2.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 113.457 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 mttm -128.92 116.0 18.71 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.444 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 90.6 m . . . . . 0 N--CA 1.496 1.874 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.9 p . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -111.59 138.04 48.65 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 121.479 0.657 . . . . 0.0 111.632 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.0 158.67 49.93 Favored Glycine 0 N--CA 1.494 2.555 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.955 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -63.89 110.91 2.26 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.919 -0.64 . . . . 0.0 110.784 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.63 16.6 9.23 Favored Glycine 0 N--CA 1.493 2.448 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.403 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -95.15 166.14 12.06 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 124.162 0.566 . . . . 0.0 110.604 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -75.22 83.99 2.4 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.016 -0.993 . . . . 0.0 109.799 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.418 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.22 -157.69 0.18 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.832 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.48 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -158.0 139.22 13.41 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.6 ptt180 -60.37 -32.25 71.12 Favored 'General case' 0 N--CA 1.5 2.025 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.478 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.71 8.0 45.26 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.407 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttp -150.19 95.23 2.25 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -83.05 56.94 3.68 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.027 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -24.63 60.98 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.828 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.9 m -54.8 141.26 33.52 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 124.454 1.096 . . . . 0.0 111.663 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.6 m -54.29 -45.32 72.49 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.937 -1.483 . . . . 0.0 112.351 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -108.27 37.5 2.47 Favored 'General case' 0 N--CA 1.499 2.001 0 CA-C-N 114.13 -1.396 . . . . 0.0 110.758 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.0 42.58 1.18 Allowed Glycine 0 N--CA 1.504 3.229 0 CA-C-N 114.482 -1.235 . . . . 0.0 112.544 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.48 -14.71 58.71 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.997 -1.102 . . . . 0.0 113.199 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' O ' ' A' ' 9' ' ' SER . 40.7 t -33.17 122.55 0.39 Allowed 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -117.27 66.1 0.73 Allowed 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 113.458 -1.701 . . . . 0.0 107.753 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.1 p 44.3 36.16 1.5 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 112.793 -2.003 . . . . 0.0 112.9 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.85 -18.75 2.75 Favored Glycine 0 N--CA 1.496 2.644 0 CA-C-N 112.987 -1.915 . . . . 0.0 113.735 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 tttm -129.82 116.57 18.91 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-N 117.762 0.781 . . . . 0.0 110.115 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.418 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.5 m . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 122.87 1.319 . . . . 0.0 111.438 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.43 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.52 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.402 ' C ' ' H ' ' A' ' 14' ' ' ASP . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 12' ' ' MET . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.455 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m . . . . . 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.0 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.58 130.29 56.07 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 123.77 0.669 . . . . 0.0 111.977 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.31 -176.49 46.87 Favored Glycine 0 N--CA 1.497 2.752 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.071 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.16 138.45 49.9 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.14 15.05 49.47 Favored Glycine 0 N--CA 1.495 2.57 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.056 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.59 153.64 23.09 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.722 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -64.28 94.17 0.11 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 114.477 -1.238 . . . . 0.0 109.539 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 5.1 p -91.05 -170.04 2.54 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.731 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.13 125.03 3.88 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-N 113.919 -1.491 . . . . 0.0 107.828 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -75.42 -15.87 60.4 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 113.532 -1.667 . . . . 0.0 109.837 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.95 -15.19 60.21 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.928 -1.033 . . . . 0.0 108.846 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' ASP . 7.5 ptp -164.52 50.89 0.12 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.071 0.857 . . . . 0.0 110.45 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -7.33 66.28 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.509 0 O-C-N 125.572 1.795 . . . . 0.0 114.947 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' MET . 0.5 OUTLIER -50.47 -28.58 8.59 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 110.829 -2.896 . . . . 0.0 113.025 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.444 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 55.5 m -60.7 140.06 57.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 124.772 1.295 . . . . 0.0 111.091 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.4 m -54.61 -45.49 73.69 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-N 114.19 -1.368 . . . . 0.0 112.231 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 m -112.47 38.57 2.7 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.646 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.08 43.76 1.9 Allowed Glycine 0 N--CA 1.503 3.144 0 CA-C-N 114.531 -1.213 . . . . 0.0 112.817 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -12.18 59.82 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.319 -0.941 . . . . 0.0 113.044 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -31.03 120.96 0.22 Allowed 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -119.09 69.83 0.82 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.47 24.39 2.99 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.884 179.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -12.9 2.88 Favored Glycine 0 N--CA 1.496 2.651 0 CA-C-O 118.681 -1.066 . . . . 0.0 113.065 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.8 mmtm -125.89 119.64 28.33 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 68.4 m . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 122.603 1.192 . . . . 0.0 113.414 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.9 p . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -107.64 141.21 39.48 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.439 0.637 . . . . 0.0 111.48 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.01 161.59 54.12 Favored Glycine 0 N--CA 1.497 2.757 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.684 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -70.69 111.83 6.46 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 0.0 111.113 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.96 15.66 19.39 Favored Glycine 0 N--CA 1.494 2.511 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.791 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.35 163.88 13.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.343 0.672 . . . . 0.0 110.348 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -65.3 104.23 0.91 Allowed 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.0 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.414 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.4 p -102.26 -161.53 0.86 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.249 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.48 140.99 11.63 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.559 0.537 . . . . 0.0 109.675 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 mtm180 -63.87 -28.24 69.71 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.65 -8.44 34.78 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.877 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -144.42 91.35 2.18 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 124.04 0.838 . . . . 0.0 109.359 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -81.0 60.02 4.03 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 113.23 -1.805 . . . . 0.0 107.772 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.73 -23.66 60.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.661 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.4 m -47.71 135.27 11.94 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 124.565 1.165 . . . . 0.0 111.71 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.56 -41.89 63.95 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 114.099 -1.409 . . . . 0.0 111.908 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.6 m -111.24 36.8 3.06 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 125.04 1.462 . . . . 0.0 111.586 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 34.61 41.94 0.28 Allowed Glycine 0 N--CA 1.509 3.557 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.77 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.84 -12.52 59.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -26.87 121.32 0.09 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -119.59 65.31 0.8 Allowed 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 113.527 -1.669 . . . . 0.0 107.57 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 7.6 t 49.93 27.75 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 112.761 -2.018 . . . . 0.0 113.414 179.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.59 -9.91 2.9 Favored Glycine 0 N--CA 1.496 2.64 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.503 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.03 113.29 13.77 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 55.3 m . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 122.717 1.246 . . . . 0.0 112.048 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.2 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -120.38 154.56 34.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-O 121.76 0.791 . . . . 0.0 112.936 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.59 179.96 46.23 Favored Glycine 0 N--CA 1.497 2.74 0 CA-C-N 113.723 -1.581 . . . . 0.0 112.694 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -57.8 138.96 55.09 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 67.79 12.4 62.06 Favored Glycine 0 N--CA 1.495 2.585 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.128 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.47 164.04 27.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.932 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 76.81 6.4 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.163 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.536 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.29 -157.79 0.19 Allowed 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.35 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.506 ' HG ' ' H ' ' A' ' 11' ' ' LEU . 46.7 t -161.02 159.55 29.5 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.638 1.208 . . . . 0.0 110.211 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -33.77 76.53 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 112.321 -2.218 . . . . 0.0 109.313 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.506 ' H ' ' HG ' ' A' ' 9' ' ' SER . 0.1 OUTLIER -97.04 1.3 49.98 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.434 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 36.3 mtp -143.39 92.56 2.38 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.953 0.882 . . . . 0.0 111.138 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -86.78 55.65 3.66 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -13.88 61.95 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.326 -1.761 . . . . 0.0 115.027 -179.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.49 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.1 m -56.14 143.79 31.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 123.931 0.77 . . . . 0.0 110.342 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.3 m -56.4 -45.15 80.76 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.366 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.5 t -104.51 34.0 3.31 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 124.812 1.32 . . . . 0.0 111.522 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.2 41.43 2.11 Favored Glycine 0 N--CA 1.502 3.044 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.066 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.54 -12.78 59.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.849 -1.175 . . . . 0.0 113.349 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 9' ' ' SER . 33.9 t -35.83 132.87 0.46 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -129.95 62.44 1.56 Allowed 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 112.911 -1.95 . . . . 0.0 107.829 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.3 m 43.13 41.66 2.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.928 -1.942 . . . . 0.0 111.946 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.34 2.28 Favored Glycine 0 N--CA 1.493 2.442 0 CA-C-N 112.946 -1.934 . . . . 0.0 113.29 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -121.65 124.98 45.6 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.014 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.536 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 11.4 m . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 122.534 1.159 . . . . 0.0 111.418 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.8 p . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -110.17 123.59 50.02 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 123.563 0.539 . . . . 0.0 109.851 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -68.93 169.45 42.5 Favored Glycine 0 N--CA 1.499 2.875 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.385 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.26 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 121.375 0.607 . . . . 0.0 112.061 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 109.43 21.13 7.41 Favored Glycine 0 N--CA 1.494 2.541 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.075 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -91.94 153.32 19.56 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -70.43 84.37 0.59 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 124.188 0.93 . . . . 0.0 108.678 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.473 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -79.79 -159.78 0.23 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.738 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.23 142.2 12.85 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.309 0.576 . . . . 0.0 110.109 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 ptt85 -62.89 -29.95 71.16 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.253 -1.339 . . . . 0.0 109.564 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.58 -1.85 42.97 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.738 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.0 mmm -147.8 92.77 2.11 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 124.1 0.875 . . . . 0.0 108.831 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -81.99 60.82 5.0 Favored 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 113.607 -1.633 . . . . 0.0 107.637 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -13.59 33.5 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.231 -1.35 . . . . 0.0 113.218 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.2 m -56.74 142.13 41.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.908 0.755 . . . . 0.0 111.496 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -51.44 -43.29 62.01 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.46 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.6 m -118.22 36.46 4.35 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.73 46.4 2.96 Favored Glycine 0 N--CA 1.503 3.117 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.317 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.29 -14.28 59.12 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 114.213 -0.993 . . . . 0.0 113.091 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.9 t -28.25 120.58 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 115.971 1.841 . . . . 0.0 115.971 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -116.35 67.66 0.72 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.291 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.4 m 49.81 28.88 2.95 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 112.958 -1.928 . . . . 0.0 113.125 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.75 -14.23 2.9 Favored Glycine 0 N--CA 1.495 2.614 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.974 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -129.03 112.33 13.91 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.473 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.8 m . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 122.676 1.227 . . . . 0.0 111.662 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.43 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.52 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.402 ' C ' ' H ' ' A' ' 14' ' ' ASP . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 12' ' ' MET . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.455 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m -69.89 135.91 50.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 119.628 -1.92 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m -64.76 81.81 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.329 0 O-C-N 118.707 -2.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m -64.76 81.81 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.329 0 O-C-N 118.707 -2.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -108.58 144.34 36.41 Favored 'General case' 0 N--CA 1.501 2.088 0 CA-C-O 121.459 0.647 . . . . 0.0 112.559 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -90.91 176.82 41.23 Favored Glycine 0 N--CA 1.496 2.668 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.383 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.8 mmtt -60.44 132.53 54.21 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.473 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.36 16.54 79.35 Favored Glycine 0 N--CA 1.493 2.47 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.563 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.65 161.31 19.31 Favored 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.49 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.8 tttt -77.0 80.69 3.53 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.946 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.501 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -79.91 -159.94 0.24 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.361 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.44 139.43 10.54 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.688 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -26.97 67.99 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.396 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.43 -13.47 23.13 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.903 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mmm -141.75 91.74 2.39 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 124.087 0.867 . . . . 0.0 108.699 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -81.56 62.46 5.43 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.185 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.63 -18.45 30.58 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 113.966 -1.47 . . . . 0.0 113.402 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.3 m -51.58 138.32 22.86 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 124.26 0.975 . . . . 0.0 111.407 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 m -54.69 -45.96 74.05 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 114.305 -1.316 . . . . 0.0 112.38 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 m -108.66 37.57 2.49 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.077 -1.42 . . . . 0.0 111.041 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.8 45.64 1.56 Allowed Glycine 0 N--CA 1.503 3.162 0 CA-C-N 114.642 -1.163 . . . . 0.0 112.182 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -14.12 59.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 113.96 -1.12 . . . . 0.0 112.841 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -31.86 130.01 0.16 Allowed 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -126.44 64.31 1.26 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.594 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m 47.25 34.92 3.37 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 112.641 -2.072 . . . . 0.0 112.314 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -23.01 2.63 Favored Glycine 0 N--CA 1.493 2.485 0 CA-C-N 113.791 -1.55 . . . . 0.0 113.119 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -122.46 120.6 34.39 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.867 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.501 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 50.9 m -69.29 84.94 0.39 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 122.622 1.201 . . . . 0.0 111.463 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.401 0 O-C-N 118.741 -2.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.8 p . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -112.26 137.91 49.71 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-O 121.524 0.678 . . . . 0.0 112.607 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.0 -170.88 46.68 Favored Glycine 0 N--CA 1.498 2.787 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.62 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -59.13 135.14 57.54 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.93 12.53 43.26 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.833 -1.076 . . . . 0.0 113.225 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.57 153.61 42.71 Favored 'General case' 0 N--CA 1.496 1.875 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.778 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -65.74 91.07 0.13 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 123.937 0.773 . . . . 0.0 111.121 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.463 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -92.89 -167.46 1.74 Allowed 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.128 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -160.25 143.01 13.39 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.466 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -64.29 -26.61 68.56 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.986 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 tp -95.96 -8.92 32.49 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.108 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.7 mtm -142.14 92.4 2.43 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -80.13 60.46 3.65 Favored 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 113.205 -1.816 . . . . 0.0 108.704 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -57.21 -27.97 62.46 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.638 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.0 m -49.74 136.28 17.83 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.462 1.101 . . . . 0.0 111.842 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -53.73 -43.78 69.34 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.26 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 m -114.8 39.7 2.79 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 114.039 -1.437 . . . . 0.0 111.309 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.9 45.48 1.6 Allowed Glycine 0 N--CA 1.506 3.334 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.717 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -11.63 59.88 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.055 -1.073 . . . . 0.0 113.488 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -28.58 133.04 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 116.042 1.868 . . . . 0.0 116.042 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 ttm105 -132.65 60.19 1.7 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 113.139 -1.846 . . . . 0.0 106.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.8 p 42.7 39.63 1.72 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-N 112.705 -2.043 . . . . 0.0 112.546 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.08 -18.5 2.71 Favored Glycine 0 N--CA 1.493 2.453 0 CA-C-N 112.605 -2.089 . . . . 0.0 112.827 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -130.36 121.98 27.01 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.28 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.463 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 30.7 m -74.28 76.33 1.84 Allowed 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 122.387 1.089 . . . . 0.0 111.117 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.325 0 O-C-N 119.027 -2.296 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.6 p . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -127.03 148.73 50.11 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -94.95 171.63 30.19 Favored Glycine 0 N--CA 1.494 2.507 0 CA-C-N 113.93 -1.486 . . . . 0.0 110.818 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -52.48 137.85 28.95 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 114.61 -0.795 . . . . 0.0 111.875 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.57 12.29 84.39 Favored Glycine 0 N--CA 1.492 2.407 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.665 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.18 167.15 11.54 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.366 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -76.47 86.63 3.2 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.884 0.85 . . . . 0.0 110.167 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.569 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 7.1 p -86.2 -170.81 3.26 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 114.163 -1.38 . . . . 0.0 112.857 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -159.95 125.22 4.02 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.89 -1.504 . . . . 0.0 107.843 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.4 -7.8 54.13 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.024 -1.444 . . . . 0.0 110.881 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.5 tp -95.21 -22.42 17.83 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.533 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' N ' ' A' ' 14' ' ' ASP . 69.5 mmm -144.36 42.37 1.39 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 123.863 0.727 . . . . 0.0 110.879 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -8.35 66.94 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 125.977 1.711 . . . . 0.0 115.017 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.3 t70 -50.45 -32.05 16.86 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 110.779 -2.919 . . . . 0.0 112.455 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 6.9 m -62.84 143.21 57.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.84 1.338 . . . . 0.0 111.015 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -57.33 -46.4 83.3 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.235 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.8 m -103.91 32.44 3.93 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.192 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 33.85 43.58 0.3 Allowed Glycine 0 N--CA 1.507 3.427 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.249 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.7 -13.06 59.74 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -21.1 125.56 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 117.349 2.352 . . . . 0.0 117.349 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -113.85 66.72 0.67 Allowed 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.265 -1.789 . . . . 0.0 107.008 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.2 t 50.38 29.45 3.87 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 113.281 -1.781 . . . . 0.0 113.037 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.5 -19.97 2.78 Favored Glycine 0 N--CA 1.497 2.701 0 CA-C-N 114.539 -1.209 . . . . 0.0 113.083 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -121.56 116.0 23.83 Favored 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.6 m -55.96 114.04 1.76 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 122.509 1.147 . . . . 0.0 113.343 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.39 0 O-C-N 119.589 -1.944 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.3 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.9 mptt -111.57 131.9 54.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 123.82 0.7 . . . . 0.0 111.405 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.02 175.31 54.6 Favored Glycine 0 N--CA 1.496 2.676 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.041 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -58.05 142.79 45.68 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.082 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.0 12.09 64.55 Favored Glycine 0 N--CA 1.493 2.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.372 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.22 158.28 23.61 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.041 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 tptt -74.81 83.22 2.14 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.49 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.75 -164.73 0.83 Allowed 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.602 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.07 127.85 4.67 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.092 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -15.83 62.94 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-N 113.497 -1.683 . . . . 0.0 112.208 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.6 -8.1 58.97 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.609 -0.836 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -163.74 38.42 0.09 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -4.74 63.88 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.917 0 O-C-N 125.76 1.913 . . . . 0.0 114.177 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.528 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.8 p30 -57.86 -17.59 17.29 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.279 -2.691 . . . . 0.0 115.054 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 45.2 m -58.15 144.15 41.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 124.24 0.963 . . . . 0.0 110.751 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.1 m -53.51 -45.41 69.71 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.608 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 m -110.3 37.5 2.7 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 125.059 1.474 . . . . 0.0 110.723 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.73 39.84 1.97 Allowed Glycine 0 N--CA 1.503 3.134 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.727 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.45 -13.75 59.37 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.671 -1.264 . . . . 0.0 112.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.446 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 17.8 t -35.4 120.62 0.56 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.899 1.374 . . . . 0.0 114.049 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -117.02 65.89 0.72 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.145 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 m 48.78 31.21 2.98 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 112.792 -2.003 . . . . 0.0 112.835 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -20.14 2.72 Favored Glycine 0 N--CA 1.496 2.647 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.422 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -123.21 118.39 27.5 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.49 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 34.2 m -68.04 84.84 0.23 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 122.677 1.227 . . . . 0.0 111.807 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.382 0 O-C-N 118.69 -2.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.8 mttm -108.12 143.96 36.15 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-O 121.474 0.654 . . . . 0.0 112.247 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.76 -178.13 40.9 Favored Glycine 0 N--CA 1.496 2.681 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.273 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -57.78 135.3 56.79 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.4 14.74 72.15 Favored Glycine 0 N--CA 1.495 2.591 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.833 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.35 155.53 28.39 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.97 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.73 82.16 1.15 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.726 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.523 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.9 p -80.71 -163.46 0.58 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.631 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 140.71 11.74 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.34 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -66.56 -24.51 66.37 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.276 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -95.39 -12.2 26.4 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 114.827 -1.078 . . . . 0.0 110.28 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 66.8 mtm -142.61 90.85 2.26 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 124.393 1.058 . . . . 0.0 108.214 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.415 ' CE2' ' HB3' ' A' ' 20' ' ' CYS . 6.2 m-85 -80.01 62.54 4.24 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-N 113.627 -1.624 . . . . 0.0 107.406 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -59.01 -22.9 61.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.622 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.9 m -51.91 137.88 25.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 124.327 1.017 . . . . 0.0 110.717 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -53.47 -45.37 69.53 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.809 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -108.51 34.14 3.8 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.815 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.45 45.6 1.37 Allowed Glycine 0 N--CA 1.505 3.26 0 CA-C-N 114.294 -1.321 . . . . 0.0 112.438 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.47 -13.63 59.44 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 12.1 t -28.68 130.42 0.06 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -125.52 65.91 1.16 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.082 -1.821 . . . . 0.0 106.082 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.4 m 47.55 34.39 3.5 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 112.688 -2.051 . . . . 0.0 112.36 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.77 -21.37 2.69 Favored Glycine 0 N--CA 1.493 2.5 0 CA-C-N 113.75 -1.568 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -123.31 120.15 32.22 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 118.111 0.955 . . . . 0.0 109.654 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.523 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 41.1 m -68.62 86.81 0.32 Allowed 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 122.501 1.143 . . . . 0.0 111.714 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.386 0 O-C-N 119.071 -2.268 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mmtm -123.52 145.29 48.98 Favored 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.912 0.863 . . . . 0.0 112.654 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.56 166.48 53.4 Favored Glycine 0 N--CA 1.495 2.608 0 CA-C-N 113.52 -1.673 . . . . 0.0 111.457 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.08 127.21 30.68 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 115.135 -0.533 . . . . 0.0 111.884 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.97 8.37 69.27 Favored Glycine 0 N--CA 1.494 2.533 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.001 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.9 162.42 16.13 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.066 0.46 . . . . 0.0 110.697 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -63.87 90.79 0.06 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.333 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.484 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 1.5 p -88.9 -172.02 3.53 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.793 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 128.59 4.75 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.748 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.3 mtm180 -73.3 -12.65 60.92 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.874 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 pp -91.66 -12.19 34.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 124.038 0.836 . . . . 0.0 110.445 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 14' ' ' ASP . 22.9 ptm -156.87 38.57 0.31 Allowed 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -5.35 64.39 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 126.23 1.812 . . . . 0.0 115.749 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 12' ' ' MET . 3.4 t0 -53.11 -31.97 44.9 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.128 -2.305 . . . . 0.0 112.145 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.484 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 25.6 m -52.76 134.91 36.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 124.334 1.021 . . . . 0.0 112.149 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.5 m -55.87 -45.52 78.49 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-N 114.206 -1.361 . . . . 0.0 112.28 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 m -108.01 36.47 2.77 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 124.784 1.303 . . . . 0.0 111.065 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.78 43.23 1.19 Allowed Glycine 0 N--CA 1.505 3.267 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.608 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.61 -14.41 58.83 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.4 t -25.08 113.29 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.42 67.77 0.65 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.602 -1.636 . . . . 0.0 107.538 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 t 50.05 28.77 3.13 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 112.361 -2.199 . . . . 0.0 113.247 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.42 -16.87 2.9 Favored Glycine 0 N--CA 1.495 2.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 113.457 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 mttm -128.92 116.0 18.71 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.444 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 90.6 m -58.09 86.09 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.294 0 O-C-N 118.628 -2.545 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.9 p . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -111.59 138.04 48.65 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 121.479 0.657 . . . . 0.0 111.632 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.0 158.67 49.93 Favored Glycine 0 N--CA 1.494 2.555 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.955 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -63.89 110.91 2.26 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.919 -0.64 . . . . 0.0 110.784 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.63 16.6 9.23 Favored Glycine 0 N--CA 1.493 2.448 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.403 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -95.15 166.14 12.06 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 124.162 0.566 . . . . 0.0 110.604 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -75.22 83.99 2.4 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.016 -0.993 . . . . 0.0 109.799 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.418 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.22 -157.69 0.18 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.832 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.48 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -158.0 139.22 13.41 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.6 ptt180 -60.37 -32.25 71.12 Favored 'General case' 0 N--CA 1.5 2.025 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.478 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.71 8.0 45.26 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.407 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttp -150.19 95.23 2.25 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -83.05 56.94 3.68 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.027 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -24.63 60.98 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.828 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.9 m -54.8 141.26 33.52 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 124.454 1.096 . . . . 0.0 111.663 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.6 m -54.29 -45.32 72.49 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.937 -1.483 . . . . 0.0 112.351 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -108.27 37.5 2.47 Favored 'General case' 0 N--CA 1.499 2.001 0 CA-C-N 114.13 -1.396 . . . . 0.0 110.758 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.0 42.58 1.18 Allowed Glycine 0 N--CA 1.504 3.229 0 CA-C-N 114.482 -1.235 . . . . 0.0 112.544 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.48 -14.71 58.71 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.997 -1.102 . . . . 0.0 113.199 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' O ' ' A' ' 9' ' ' SER . 40.7 t -33.17 122.55 0.39 Allowed 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -117.27 66.1 0.73 Allowed 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 113.458 -1.701 . . . . 0.0 107.753 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.1 p 44.3 36.16 1.5 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 112.793 -2.003 . . . . 0.0 112.9 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.85 -18.75 2.75 Favored Glycine 0 N--CA 1.496 2.644 0 CA-C-N 112.987 -1.915 . . . . 0.0 113.735 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 tttm -129.82 116.57 18.91 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-N 117.762 0.781 . . . . 0.0 110.115 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.418 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.5 m -65.28 90.65 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 122.87 1.319 . . . . 0.0 111.438 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.344 0 O-C-N 118.743 -2.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.43 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.52 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.402 ' C ' ' H ' ' A' ' 14' ' ' ASP . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 12' ' ' MET . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.455 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m -69.89 135.91 50.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 119.628 -1.92 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.0 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.58 130.29 56.07 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 123.77 0.669 . . . . 0.0 111.977 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.31 -176.49 46.87 Favored Glycine 0 N--CA 1.497 2.752 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.071 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.16 138.45 49.9 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.14 15.05 49.47 Favored Glycine 0 N--CA 1.495 2.57 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.056 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.59 153.64 23.09 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.722 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -64.28 94.17 0.11 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 114.477 -1.238 . . . . 0.0 109.539 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 5.1 p -91.05 -170.04 2.54 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.731 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.13 125.03 3.88 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-N 113.919 -1.491 . . . . 0.0 107.828 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -75.42 -15.87 60.4 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 113.532 -1.667 . . . . 0.0 109.837 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.95 -15.19 60.21 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.928 -1.033 . . . . 0.0 108.846 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' ASP . 7.5 ptp -164.52 50.89 0.12 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.071 0.857 . . . . 0.0 110.45 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -7.33 66.28 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.509 0 O-C-N 125.572 1.795 . . . . 0.0 114.947 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' MET . 0.5 OUTLIER -50.47 -28.58 8.59 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 110.829 -2.896 . . . . 0.0 113.025 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.444 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 55.5 m -60.7 140.06 57.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 124.772 1.295 . . . . 0.0 111.091 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.4 m -54.61 -45.49 73.69 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-N 114.19 -1.368 . . . . 0.0 112.231 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 m -112.47 38.57 2.7 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.646 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.08 43.76 1.9 Allowed Glycine 0 N--CA 1.503 3.144 0 CA-C-N 114.531 -1.213 . . . . 0.0 112.817 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -12.18 59.82 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.319 -0.941 . . . . 0.0 113.044 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -31.03 120.96 0.22 Allowed 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -119.09 69.83 0.82 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.47 24.39 2.99 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.884 179.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -12.9 2.88 Favored Glycine 0 N--CA 1.496 2.651 0 CA-C-O 118.681 -1.066 . . . . 0.0 113.065 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.8 mmtm -125.89 119.64 28.33 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 68.4 m -67.05 84.54 0.13 Allowed 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 122.603 1.192 . . . . 0.0 113.414 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.407 0 O-C-N 119.039 -2.288 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.9 p . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -107.64 141.21 39.48 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.439 0.637 . . . . 0.0 111.48 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.01 161.59 54.12 Favored Glycine 0 N--CA 1.497 2.757 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.684 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -70.69 111.83 6.46 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 0.0 111.113 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.96 15.66 19.39 Favored Glycine 0 N--CA 1.494 2.511 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.791 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.35 163.88 13.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.343 0.672 . . . . 0.0 110.348 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -65.3 104.23 0.91 Allowed 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.0 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.414 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.4 p -102.26 -161.53 0.86 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.249 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.48 140.99 11.63 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.559 0.537 . . . . 0.0 109.675 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 mtm180 -63.87 -28.24 69.71 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.65 -8.44 34.78 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.877 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -144.42 91.35 2.18 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 124.04 0.838 . . . . 0.0 109.359 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -81.0 60.02 4.03 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 113.23 -1.805 . . . . 0.0 107.772 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.73 -23.66 60.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.661 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.4 m -47.71 135.27 11.94 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 124.565 1.165 . . . . 0.0 111.71 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.56 -41.89 63.95 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 114.099 -1.409 . . . . 0.0 111.908 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.6 m -111.24 36.8 3.06 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 125.04 1.462 . . . . 0.0 111.586 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 34.61 41.94 0.28 Allowed Glycine 0 N--CA 1.509 3.557 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.77 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.84 -12.52 59.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -26.87 121.32 0.09 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -119.59 65.31 0.8 Allowed 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 113.527 -1.669 . . . . 0.0 107.57 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 7.6 t 49.93 27.75 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 112.761 -2.018 . . . . 0.0 113.414 179.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.59 -9.91 2.9 Favored Glycine 0 N--CA 1.496 2.64 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.503 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.03 113.29 13.77 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 55.3 m -65.11 86.11 0.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 122.717 1.246 . . . . 0.0 112.048 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.346 0 O-C-N 118.762 -2.461 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.2 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -120.38 154.56 34.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-O 121.76 0.791 . . . . 0.0 112.936 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.59 179.96 46.23 Favored Glycine 0 N--CA 1.497 2.74 0 CA-C-N 113.723 -1.581 . . . . 0.0 112.694 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -57.8 138.96 55.09 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 67.79 12.4 62.06 Favored Glycine 0 N--CA 1.495 2.585 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.128 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -73.47 164.04 27.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.932 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 76.81 6.4 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.163 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.536 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.29 -157.79 0.19 Allowed 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.35 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.506 ' HG ' ' H ' ' A' ' 11' ' ' LEU . 46.7 t -161.02 159.55 29.5 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.638 1.208 . . . . 0.0 110.211 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -33.77 76.53 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 112.321 -2.218 . . . . 0.0 109.313 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.506 ' H ' ' HG ' ' A' ' 9' ' ' SER . 0.1 OUTLIER -97.04 1.3 49.98 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.434 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 36.3 mtp -143.39 92.56 2.38 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.953 0.882 . . . . 0.0 111.138 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -86.78 55.65 3.66 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -13.88 61.95 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.326 -1.761 . . . . 0.0 115.027 -179.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.49 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.1 m -56.14 143.79 31.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 123.931 0.77 . . . . 0.0 110.342 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.3 m -56.4 -45.15 80.76 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.366 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.5 t -104.51 34.0 3.31 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 124.812 1.32 . . . . 0.0 111.522 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.2 41.43 2.11 Favored Glycine 0 N--CA 1.502 3.044 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.066 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.54 -12.78 59.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.849 -1.175 . . . . 0.0 113.349 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 9' ' ' SER . 33.9 t -35.83 132.87 0.46 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -129.95 62.44 1.56 Allowed 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 112.911 -1.95 . . . . 0.0 107.829 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.3 m 43.13 41.66 2.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.928 -1.942 . . . . 0.0 111.946 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.34 2.28 Favored Glycine 0 N--CA 1.493 2.442 0 CA-C-N 112.946 -1.934 . . . . 0.0 113.29 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -121.65 124.98 45.6 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.014 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.536 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 11.4 m -75.56 72.95 2.56 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.534 1.159 . . . . 0.0 111.418 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.365 0 O-C-N 118.523 -2.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.8 p . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -110.17 123.59 50.02 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 123.563 0.539 . . . . 0.0 109.851 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -68.93 169.45 42.5 Favored Glycine 0 N--CA 1.499 2.875 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.385 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.26 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 121.375 0.607 . . . . 0.0 112.061 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 109.43 21.13 7.41 Favored Glycine 0 N--CA 1.494 2.541 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.075 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -91.94 153.32 19.56 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -70.43 84.37 0.59 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 124.188 0.93 . . . . 0.0 108.678 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.473 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -79.79 -159.78 0.23 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.738 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.23 142.2 12.85 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.309 0.576 . . . . 0.0 110.109 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 ptt85 -62.89 -29.95 71.16 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.253 -1.339 . . . . 0.0 109.564 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.58 -1.85 42.97 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.738 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.0 mmm -147.8 92.77 2.11 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 124.1 0.875 . . . . 0.0 108.831 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -81.99 60.82 5.0 Favored 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 113.607 -1.633 . . . . 0.0 107.637 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -13.59 33.5 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.231 -1.35 . . . . 0.0 113.218 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.2 m -56.74 142.13 41.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.908 0.755 . . . . 0.0 111.496 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -51.44 -43.29 62.01 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.46 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.6 m -118.22 36.46 4.35 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.73 46.4 2.96 Favored Glycine 0 N--CA 1.503 3.117 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.317 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.29 -14.28 59.12 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 114.213 -0.993 . . . . 0.0 113.091 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.9 t -28.25 120.58 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 115.971 1.841 . . . . 0.0 115.971 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -116.35 67.66 0.72 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.291 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.4 m 49.81 28.88 2.95 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 112.958 -1.928 . . . . 0.0 113.125 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.75 -14.23 2.9 Favored Glycine 0 N--CA 1.495 2.614 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.974 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -129.03 112.33 13.91 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.473 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.8 m -61.73 95.09 0.05 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 122.676 1.227 . . . . 0.0 111.662 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.396 0 O-C-N 118.861 -2.399 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.504 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.51 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m . . . . . 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -108.58 144.34 36.41 Favored 'General case' 0 N--CA 1.501 2.088 0 CA-C-O 121.459 0.647 . . . . 0.0 112.559 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -90.91 176.82 41.23 Favored Glycine 0 N--CA 1.496 2.668 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.383 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.8 mmtt -60.44 132.53 54.21 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.473 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.36 16.54 79.35 Favored Glycine 0 N--CA 1.493 2.47 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.563 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.65 161.31 19.31 Favored 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.49 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.8 tttt -77.0 80.69 3.53 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.946 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.525 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -79.91 -159.94 0.24 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.361 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.44 139.43 10.54 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.688 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -26.97 67.99 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.396 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.43 -13.47 23.13 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.903 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mmm -141.75 91.74 2.39 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 124.087 0.867 . . . . 0.0 108.699 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -81.56 62.46 5.43 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.185 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.63 -18.45 30.58 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 113.966 -1.47 . . . . 0.0 113.402 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.3 m -51.58 138.32 22.86 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 124.26 0.975 . . . . 0.0 111.407 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 m -54.69 -45.96 74.05 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 114.305 -1.316 . . . . 0.0 112.38 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 m -108.66 37.57 2.49 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.077 -1.42 . . . . 0.0 111.041 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.8 45.64 1.56 Allowed Glycine 0 N--CA 1.503 3.162 0 CA-C-N 114.642 -1.163 . . . . 0.0 112.182 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -14.12 59.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 113.96 -1.12 . . . . 0.0 112.841 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -31.86 130.01 0.16 Allowed 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -126.44 64.31 1.26 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.594 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m 47.25 34.92 3.37 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 112.641 -2.072 . . . . 0.0 112.314 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -23.01 2.63 Favored Glycine 0 N--CA 1.493 2.485 0 CA-C-N 113.791 -1.55 . . . . 0.0 113.119 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -122.46 120.6 34.39 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.867 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.525 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 50.9 m . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 122.622 1.201 . . . . 0.0 111.463 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.8 p . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -112.26 137.91 49.71 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-O 121.524 0.678 . . . . 0.0 112.607 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.0 -170.88 46.68 Favored Glycine 0 N--CA 1.498 2.787 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.62 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -59.13 135.14 57.54 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.93 12.53 43.26 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.833 -1.076 . . . . 0.0 113.225 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.57 153.61 42.71 Favored 'General case' 0 N--CA 1.496 1.875 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.778 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -65.74 91.07 0.13 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 123.937 0.773 . . . . 0.0 111.121 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -92.89 -167.46 1.74 Allowed 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.128 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -160.25 143.01 13.39 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.466 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -64.29 -26.61 68.56 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.986 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 tp -95.96 -8.92 32.49 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.108 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.7 mtm -142.14 92.4 2.43 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -80.13 60.46 3.65 Favored 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 113.205 -1.816 . . . . 0.0 108.704 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -57.21 -27.97 62.46 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.638 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.0 m -49.74 136.28 17.83 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.462 1.101 . . . . 0.0 111.842 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -53.73 -43.78 69.34 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.26 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 m -114.8 39.7 2.79 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 114.039 -1.437 . . . . 0.0 111.309 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.9 45.48 1.6 Allowed Glycine 0 N--CA 1.506 3.334 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.717 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -11.63 59.88 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.055 -1.073 . . . . 0.0 113.488 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -28.58 133.04 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 116.042 1.868 . . . . 0.0 116.042 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 ttm105 -132.65 60.19 1.7 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 113.139 -1.846 . . . . 0.0 106.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.8 p 42.7 39.63 1.72 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-N 112.705 -2.043 . . . . 0.0 112.546 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.08 -18.5 2.71 Favored Glycine 0 N--CA 1.493 2.453 0 CA-C-N 112.605 -2.089 . . . . 0.0 112.827 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -130.36 121.98 27.01 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.28 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 30.7 m . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 122.387 1.089 . . . . 0.0 111.117 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.6 p . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -127.03 148.73 50.11 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -94.95 171.63 30.19 Favored Glycine 0 N--CA 1.494 2.507 0 CA-C-N 113.93 -1.486 . . . . 0.0 110.818 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -52.48 137.85 28.95 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 114.61 -0.795 . . . . 0.0 111.875 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.57 12.29 84.39 Favored Glycine 0 N--CA 1.492 2.407 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.665 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.18 167.15 11.54 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.366 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.422 ' HD3' ' HZ3' ' A' ' 24' ' ' LYS . 1.3 mppt? -76.47 86.63 3.2 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.884 0.85 . . . . 0.0 110.167 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.597 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 7.1 p -86.2 -170.81 3.26 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 114.163 -1.38 . . . . 0.0 112.857 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -159.95 125.22 4.02 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.89 -1.504 . . . . 0.0 107.843 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.4 -7.8 54.13 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.024 -1.444 . . . . 0.0 110.881 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.5 tp -95.21 -22.42 17.83 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.533 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' N ' ' A' ' 14' ' ' ASP . 69.5 mmm -144.36 42.37 1.39 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 123.863 0.727 . . . . 0.0 110.879 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -8.35 66.94 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 125.977 1.711 . . . . 0.0 115.017 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.3 t70 -50.45 -32.05 16.86 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 110.779 -2.919 . . . . 0.0 112.455 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 6.9 m -62.84 143.21 57.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.84 1.338 . . . . 0.0 111.015 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -57.33 -46.4 83.3 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.235 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.8 m -103.91 32.44 3.93 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.192 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 33.85 43.58 0.3 Allowed Glycine 0 N--CA 1.507 3.427 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.249 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.7 -13.06 59.74 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -21.1 125.56 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 117.349 2.352 . . . . 0.0 117.349 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -113.85 66.72 0.67 Allowed 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.265 -1.789 . . . . 0.0 107.008 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.2 t 50.38 29.45 3.87 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 113.281 -1.781 . . . . 0.0 113.037 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.5 -19.97 2.78 Favored Glycine 0 N--CA 1.497 2.701 0 CA-C-N 114.539 -1.209 . . . . 0.0 113.083 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HZ3' ' HD3' ' A' ' 7' ' ' LYS . 6.9 mmpt? -121.56 116.0 23.83 Favored 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.6 m . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 122.509 1.147 . . . . 0.0 113.343 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.3 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 4.9 mptt -111.57 131.9 54.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 123.82 0.7 . . . . 0.0 111.405 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.02 175.31 54.6 Favored Glycine 0 N--CA 1.496 2.676 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.041 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -58.05 142.79 45.68 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.082 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.0 12.09 64.55 Favored Glycine 0 N--CA 1.493 2.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.372 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.22 158.28 23.61 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.041 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 tptt -74.81 83.22 2.14 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.506 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.75 -164.73 0.83 Allowed 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.602 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.07 127.85 4.67 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.092 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -15.83 62.94 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-N 113.497 -1.683 . . . . 0.0 112.208 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.6 -8.1 58.97 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.609 -0.836 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -163.74 38.42 0.09 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -4.74 63.88 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.917 0 O-C-N 125.76 1.913 . . . . 0.0 114.177 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.528 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.8 p30 -57.86 -17.59 17.29 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.279 -2.691 . . . . 0.0 115.054 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 45.2 m -58.15 144.15 41.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 124.24 0.963 . . . . 0.0 110.751 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.1 m -53.51 -45.41 69.71 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.608 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 m -110.3 37.5 2.7 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 125.059 1.474 . . . . 0.0 110.723 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.73 39.84 1.97 Allowed Glycine 0 N--CA 1.503 3.134 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.727 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.45 -13.75 59.37 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.671 -1.264 . . . . 0.0 112.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.469 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 17.8 t -35.4 120.62 0.56 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.899 1.374 . . . . 0.0 114.049 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -117.02 65.89 0.72 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.145 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 m 48.78 31.21 2.98 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 112.792 -2.003 . . . . 0.0 112.835 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -20.14 2.72 Favored Glycine 0 N--CA 1.496 2.647 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.422 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -123.21 118.39 27.5 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 34.2 m . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 122.677 1.227 . . . . 0.0 111.807 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.8 mttm -108.12 143.96 36.15 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-O 121.474 0.654 . . . . 0.0 112.247 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.76 -178.13 40.9 Favored Glycine 0 N--CA 1.496 2.681 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.273 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -57.78 135.3 56.79 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.4 14.74 72.15 Favored Glycine 0 N--CA 1.495 2.591 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.833 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.35 155.53 28.39 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.97 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.73 82.16 1.15 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.726 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.547 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.9 p -80.71 -163.46 0.58 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.631 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 140.71 11.74 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.34 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -66.56 -24.51 66.37 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.276 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.409 HD23 ' H ' ' A' ' 11' ' ' LEU . 0.5 OUTLIER -95.39 -12.2 26.4 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 114.827 -1.078 . . . . 0.0 110.28 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 66.8 mtm -142.61 90.85 2.26 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 124.393 1.058 . . . . 0.0 108.214 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' A' ' 20' ' ' CYS . 6.2 m-85 -80.01 62.54 4.24 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-N 113.627 -1.624 . . . . 0.0 107.406 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -59.01 -22.9 61.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.622 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.9 m -51.91 137.88 25.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 124.327 1.017 . . . . 0.0 110.717 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -53.47 -45.37 69.53 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.809 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -108.51 34.14 3.8 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.815 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.45 45.6 1.37 Allowed Glycine 0 N--CA 1.505 3.26 0 CA-C-N 114.294 -1.321 . . . . 0.0 112.438 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.47 -13.63 59.44 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 12.1 t -28.68 130.42 0.06 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -125.52 65.91 1.16 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.082 -1.821 . . . . 0.0 106.082 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.4 m 47.55 34.39 3.5 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 112.688 -2.051 . . . . 0.0 112.36 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.77 -21.37 2.69 Favored Glycine 0 N--CA 1.493 2.5 0 CA-C-N 113.75 -1.568 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -123.31 120.15 32.22 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 118.111 0.955 . . . . 0.0 109.654 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 41.1 m . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 122.501 1.143 . . . . 0.0 111.714 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mmtm -123.52 145.29 48.98 Favored 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.912 0.863 . . . . 0.0 112.654 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.56 166.48 53.4 Favored Glycine 0 N--CA 1.495 2.608 0 CA-C-N 113.52 -1.673 . . . . 0.0 111.457 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.08 127.21 30.68 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 115.135 -0.533 . . . . 0.0 111.884 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.97 8.37 69.27 Favored Glycine 0 N--CA 1.494 2.533 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.001 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.9 162.42 16.13 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.066 0.46 . . . . 0.0 110.697 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -63.87 90.79 0.06 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.333 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.514 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 1.5 p -88.9 -172.02 3.53 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.793 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 128.59 4.75 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.748 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.3 mtm180 -73.3 -12.65 60.92 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.874 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 pp -91.66 -12.19 34.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 124.038 0.836 . . . . 0.0 110.445 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 14' ' ' ASP . 22.9 ptm -156.87 38.57 0.31 Allowed 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -5.35 64.39 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 126.23 1.812 . . . . 0.0 115.749 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 12' ' ' MET . 3.4 t0 -53.11 -31.97 44.9 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.128 -2.305 . . . . 0.0 112.145 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 25.6 m -52.76 134.91 36.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 124.334 1.021 . . . . 0.0 112.149 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.5 m -55.87 -45.52 78.49 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-N 114.206 -1.361 . . . . 0.0 112.28 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 m -108.01 36.47 2.77 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 124.784 1.303 . . . . 0.0 111.065 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.78 43.23 1.19 Allowed Glycine 0 N--CA 1.505 3.267 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.608 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.61 -14.41 58.83 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.4 t -25.08 113.29 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.42 67.77 0.65 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.602 -1.636 . . . . 0.0 107.538 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 t 50.05 28.77 3.13 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 112.361 -2.199 . . . . 0.0 113.247 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.42 -16.87 2.9 Favored Glycine 0 N--CA 1.495 2.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 113.457 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 mttm -128.92 116.0 18.71 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 90.6 m . . . . . 0 N--CA 1.496 1.874 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.9 p . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -111.59 138.04 48.65 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 121.479 0.657 . . . . 0.0 111.632 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.0 158.67 49.93 Favored Glycine 0 N--CA 1.494 2.555 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.955 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -63.89 110.91 2.26 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.919 -0.64 . . . . 0.0 110.784 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.63 16.6 9.23 Favored Glycine 0 N--CA 1.493 2.448 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.458 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -95.15 166.14 12.06 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 124.162 0.566 . . . . 0.0 110.604 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -75.22 83.99 2.4 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.016 -0.993 . . . . 0.0 109.799 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.423 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.22 -157.69 0.18 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.832 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.48 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -158.0 139.22 13.41 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.6 ptt180 -60.37 -32.25 71.12 Favored 'General case' 0 N--CA 1.5 2.025 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.478 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.71 8.0 45.26 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.407 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttp -150.19 95.23 2.25 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -83.05 56.94 3.68 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.027 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -24.63 60.98 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.828 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.9 m -54.8 141.26 33.52 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 124.454 1.096 . . . . 0.0 111.663 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.6 m -54.29 -45.32 72.49 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.937 -1.483 . . . . 0.0 112.351 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -108.27 37.5 2.47 Favored 'General case' 0 N--CA 1.499 2.001 0 CA-C-N 114.13 -1.396 . . . . 0.0 110.758 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.0 42.58 1.18 Allowed Glycine 0 N--CA 1.504 3.229 0 CA-C-N 114.482 -1.235 . . . . 0.0 112.544 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.48 -14.71 58.71 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.997 -1.102 . . . . 0.0 113.199 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' O ' ' A' ' 9' ' ' SER . 40.7 t -33.17 122.55 0.39 Allowed 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -117.27 66.1 0.73 Allowed 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 113.458 -1.701 . . . . 0.0 107.753 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.1 p 44.3 36.16 1.5 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 112.793 -2.003 . . . . 0.0 112.9 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.85 -18.75 2.75 Favored Glycine 0 N--CA 1.496 2.644 0 CA-C-N 112.987 -1.915 . . . . 0.0 113.735 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 tttm -129.82 116.57 18.91 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-N 117.762 0.781 . . . . 0.0 110.115 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.458 ' HB2' ' H ' ' A' ' 6' ' ' ALA . 56.5 m . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 122.87 1.319 . . . . 0.0 111.438 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.504 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.51 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m . . . . . 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.0 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.58 130.29 56.07 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 123.77 0.669 . . . . 0.0 111.977 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.31 -176.49 46.87 Favored Glycine 0 N--CA 1.497 2.752 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.071 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.16 138.45 49.9 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.14 15.05 49.47 Favored Glycine 0 N--CA 1.495 2.57 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.056 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.59 153.64 23.09 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.722 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -64.28 94.17 0.11 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 114.477 -1.238 . . . . 0.0 109.539 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.58 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 5.1 p -91.05 -170.04 2.54 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.731 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.13 125.03 3.88 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-N 113.919 -1.491 . . . . 0.0 107.828 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.401 ' NE ' ' H ' ' A' ' 22' ' ' SER . 96.8 mtt180 -75.42 -15.87 60.4 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 113.532 -1.667 . . . . 0.0 109.837 -179.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.417 ' N ' HD12 ' A' ' 11' ' ' LEU . 9.1 mp -75.95 -15.19 60.21 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.928 -1.033 . . . . 0.0 108.846 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' ASP . 7.5 ptp -164.52 50.89 0.12 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.071 0.857 . . . . 0.0 110.45 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -7.33 66.28 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.509 0 O-C-N 125.572 1.795 . . . . 0.0 114.947 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' MET . 0.5 OUTLIER -50.47 -28.58 8.59 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 110.829 -2.896 . . . . 0.0 113.025 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.444 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 55.5 m -60.7 140.06 57.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 124.772 1.295 . . . . 0.0 111.091 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.4 m -54.61 -45.49 73.69 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-N 114.19 -1.368 . . . . 0.0 112.231 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 m -112.47 38.57 2.7 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.646 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.08 43.76 1.9 Allowed Glycine 0 N--CA 1.503 3.144 0 CA-C-N 114.531 -1.213 . . . . 0.0 112.817 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -12.18 59.82 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.319 -0.941 . . . . 0.0 113.044 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -31.03 120.96 0.22 Allowed 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -119.09 69.83 0.82 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.401 ' H ' ' NE ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 52.47 24.39 2.99 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.884 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -12.9 2.88 Favored Glycine 0 N--CA 1.496 2.651 0 CA-C-O 118.681 -1.066 . . . . 0.0 113.065 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.8 mmtm -125.89 119.64 28.33 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 68.4 m . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 122.603 1.192 . . . . 0.0 113.414 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.9 p . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -107.64 141.21 39.48 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.439 0.637 . . . . 0.0 111.48 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.01 161.59 54.12 Favored Glycine 0 N--CA 1.497 2.757 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.684 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -70.69 111.83 6.46 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 0.0 111.113 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.96 15.66 19.39 Favored Glycine 0 N--CA 1.494 2.511 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.791 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.35 163.88 13.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.343 0.672 . . . . 0.0 110.348 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -65.3 104.23 0.91 Allowed 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.0 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.4 p -102.26 -161.53 0.86 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.249 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.48 140.99 11.63 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.559 0.537 . . . . 0.0 109.675 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 mtm180 -63.87 -28.24 69.71 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.65 -8.44 34.78 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.877 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -144.42 91.35 2.18 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 124.04 0.838 . . . . 0.0 109.359 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -81.0 60.02 4.03 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 113.23 -1.805 . . . . 0.0 107.772 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.73 -23.66 60.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.661 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.4 m -47.71 135.27 11.94 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 124.565 1.165 . . . . 0.0 111.71 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.56 -41.89 63.95 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 114.099 -1.409 . . . . 0.0 111.908 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.6 m -111.24 36.8 3.06 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 125.04 1.462 . . . . 0.0 111.586 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 34.61 41.94 0.28 Allowed Glycine 0 N--CA 1.509 3.557 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.77 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.84 -12.52 59.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -26.87 121.32 0.09 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -119.59 65.31 0.8 Allowed 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 113.527 -1.669 . . . . 0.0 107.57 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 7.6 t 49.93 27.75 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 112.761 -2.018 . . . . 0.0 113.414 179.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.59 -9.91 2.9 Favored Glycine 0 N--CA 1.496 2.64 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.503 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.03 113.29 13.77 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 55.3 m . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 122.717 1.246 . . . . 0.0 112.048 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.2 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -120.38 154.56 34.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-O 121.76 0.791 . . . . 0.0 112.936 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.59 179.96 46.23 Favored Glycine 0 N--CA 1.497 2.74 0 CA-C-N 113.723 -1.581 . . . . 0.0 112.694 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -57.8 138.96 55.09 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 67.79 12.4 62.06 Favored Glycine 0 N--CA 1.495 2.585 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.128 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.427 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -73.47 164.04 27.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 76.81 6.4 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.163 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.29 -157.79 0.19 Allowed 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.35 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.502 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 46.7 t -161.02 159.55 29.5 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.638 1.208 . . . . 0.0 110.211 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -33.77 76.53 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 112.321 -2.218 . . . . 0.0 109.313 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.04 1.3 49.98 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.434 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 36.3 mtp -143.39 92.56 2.38 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.953 0.882 . . . . 0.0 111.138 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -86.78 55.65 3.66 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -13.88 61.95 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.326 -1.761 . . . . 0.0 115.027 -179.426 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.511 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.1 m -56.14 143.79 31.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 123.931 0.77 . . . . 0.0 110.342 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.3 m -56.4 -45.15 80.76 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.366 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.5 t -104.51 34.0 3.31 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 124.812 1.32 . . . . 0.0 111.522 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.2 41.43 2.11 Favored Glycine 0 N--CA 1.502 3.044 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.066 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.54 -12.78 59.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.849 -1.175 . . . . 0.0 113.349 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.511 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 33.9 t -35.83 132.87 0.46 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -129.95 62.44 1.56 Allowed 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 112.911 -1.95 . . . . 0.0 107.829 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.3 m 43.13 41.66 2.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.928 -1.942 . . . . 0.0 111.946 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.34 2.28 Favored Glycine 0 N--CA 1.493 2.442 0 CA-C-N 112.946 -1.934 . . . . 0.0 113.29 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -121.65 124.98 45.6 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.014 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.568 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 11.4 m . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 122.534 1.159 . . . . 0.0 111.418 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.8 p . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -110.17 123.59 50.02 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 123.563 0.539 . . . . 0.0 109.851 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -68.93 169.45 42.5 Favored Glycine 0 N--CA 1.499 2.875 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.385 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.26 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 121.375 0.607 . . . . 0.0 112.061 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 109.43 21.13 7.41 Favored Glycine 0 N--CA 1.494 2.541 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.075 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.442 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -91.94 153.32 19.56 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -70.43 84.37 0.59 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 124.188 0.93 . . . . 0.0 108.678 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.494 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -79.79 -159.78 0.23 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.738 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.23 142.2 12.85 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.309 0.576 . . . . 0.0 110.109 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 ptt85 -62.89 -29.95 71.16 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.253 -1.339 . . . . 0.0 109.564 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.58 -1.85 42.97 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.738 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.0 mmm -147.8 92.77 2.11 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 124.1 0.875 . . . . 0.0 108.831 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -81.99 60.82 5.0 Favored 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 113.607 -1.633 . . . . 0.0 107.637 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -13.59 33.5 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.231 -1.35 . . . . 0.0 113.218 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.2 m -56.74 142.13 41.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.908 0.755 . . . . 0.0 111.496 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -51.44 -43.29 62.01 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.46 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.6 m -118.22 36.46 4.35 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.73 46.4 2.96 Favored Glycine 0 N--CA 1.503 3.117 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.317 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.29 -14.28 59.12 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 114.213 -0.993 . . . . 0.0 113.091 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.9 t -28.25 120.58 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 115.971 1.841 . . . . 0.0 115.971 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -116.35 67.66 0.72 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.291 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.4 m 49.81 28.88 2.95 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 112.958 -1.928 . . . . 0.0 113.125 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.75 -14.23 2.9 Favored Glycine 0 N--CA 1.495 2.614 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.974 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -129.03 112.33 13.91 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.8 m . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 122.676 1.227 . . . . 0.0 111.662 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.504 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.51 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m -69.89 135.91 50.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 119.628 -1.92 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m -64.76 81.81 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.329 0 O-C-N 118.707 -2.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m -64.76 81.81 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.329 0 O-C-N 118.707 -2.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -108.58 144.34 36.41 Favored 'General case' 0 N--CA 1.501 2.088 0 CA-C-O 121.459 0.647 . . . . 0.0 112.559 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -90.91 176.82 41.23 Favored Glycine 0 N--CA 1.496 2.668 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.383 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.8 mmtt -60.44 132.53 54.21 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.473 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.36 16.54 79.35 Favored Glycine 0 N--CA 1.493 2.47 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.563 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.65 161.31 19.31 Favored 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.49 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.8 tttt -77.0 80.69 3.53 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.946 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.525 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -79.91 -159.94 0.24 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.361 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.44 139.43 10.54 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.688 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -26.97 67.99 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.396 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.43 -13.47 23.13 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.903 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mmm -141.75 91.74 2.39 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 124.087 0.867 . . . . 0.0 108.699 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -81.56 62.46 5.43 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.185 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.63 -18.45 30.58 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 113.966 -1.47 . . . . 0.0 113.402 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.3 m -51.58 138.32 22.86 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 124.26 0.975 . . . . 0.0 111.407 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 m -54.69 -45.96 74.05 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 114.305 -1.316 . . . . 0.0 112.38 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 m -108.66 37.57 2.49 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.077 -1.42 . . . . 0.0 111.041 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.8 45.64 1.56 Allowed Glycine 0 N--CA 1.503 3.162 0 CA-C-N 114.642 -1.163 . . . . 0.0 112.182 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -14.12 59.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 113.96 -1.12 . . . . 0.0 112.841 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -31.86 130.01 0.16 Allowed 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -126.44 64.31 1.26 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.594 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m 47.25 34.92 3.37 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 112.641 -2.072 . . . . 0.0 112.314 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -23.01 2.63 Favored Glycine 0 N--CA 1.493 2.485 0 CA-C-N 113.791 -1.55 . . . . 0.0 113.119 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -122.46 120.6 34.39 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.867 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.525 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 50.9 m -69.29 84.94 0.39 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 122.622 1.201 . . . . 0.0 111.463 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.401 0 O-C-N 118.741 -2.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.8 p . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -112.26 137.91 49.71 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-O 121.524 0.678 . . . . 0.0 112.607 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.0 -170.88 46.68 Favored Glycine 0 N--CA 1.498 2.787 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.62 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -59.13 135.14 57.54 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.93 12.53 43.26 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.833 -1.076 . . . . 0.0 113.225 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.57 153.61 42.71 Favored 'General case' 0 N--CA 1.496 1.875 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.778 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -65.74 91.07 0.13 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 123.937 0.773 . . . . 0.0 111.121 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -92.89 -167.46 1.74 Allowed 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.128 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -160.25 143.01 13.39 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.466 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -64.29 -26.61 68.56 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.986 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 tp -95.96 -8.92 32.49 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.108 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.7 mtm -142.14 92.4 2.43 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -80.13 60.46 3.65 Favored 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 113.205 -1.816 . . . . 0.0 108.704 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -57.21 -27.97 62.46 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.638 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.0 m -49.74 136.28 17.83 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.462 1.101 . . . . 0.0 111.842 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -53.73 -43.78 69.34 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.26 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 m -114.8 39.7 2.79 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 114.039 -1.437 . . . . 0.0 111.309 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.9 45.48 1.6 Allowed Glycine 0 N--CA 1.506 3.334 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.717 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -11.63 59.88 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.055 -1.073 . . . . 0.0 113.488 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -28.58 133.04 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 116.042 1.868 . . . . 0.0 116.042 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 ttm105 -132.65 60.19 1.7 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 113.139 -1.846 . . . . 0.0 106.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.8 p 42.7 39.63 1.72 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-N 112.705 -2.043 . . . . 0.0 112.546 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.08 -18.5 2.71 Favored Glycine 0 N--CA 1.493 2.453 0 CA-C-N 112.605 -2.089 . . . . 0.0 112.827 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -130.36 121.98 27.01 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.28 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 30.7 m -74.28 76.33 1.84 Allowed 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 122.387 1.089 . . . . 0.0 111.117 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.325 0 O-C-N 119.027 -2.296 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.6 p . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -127.03 148.73 50.11 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -94.95 171.63 30.19 Favored Glycine 0 N--CA 1.494 2.507 0 CA-C-N 113.93 -1.486 . . . . 0.0 110.818 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -52.48 137.85 28.95 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 114.61 -0.795 . . . . 0.0 111.875 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.57 12.29 84.39 Favored Glycine 0 N--CA 1.492 2.407 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.665 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.18 167.15 11.54 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.366 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.422 ' HD3' ' HZ3' ' A' ' 24' ' ' LYS . 1.3 mppt? -76.47 86.63 3.2 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.884 0.85 . . . . 0.0 110.167 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 7.1 p -86.2 -170.81 3.26 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 114.163 -1.38 . . . . 0.0 112.857 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -159.95 125.22 4.02 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.89 -1.504 . . . . 0.0 107.843 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.4 -7.8 54.13 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.024 -1.444 . . . . 0.0 110.881 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.5 tp -95.21 -22.42 17.83 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.533 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' N ' ' A' ' 14' ' ' ASP . 69.5 mmm -144.36 42.37 1.39 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 123.863 0.727 . . . . 0.0 110.879 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -8.35 66.94 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 125.977 1.711 . . . . 0.0 115.017 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.3 t70 -50.45 -32.05 16.86 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 110.779 -2.919 . . . . 0.0 112.455 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 6.9 m -62.84 143.21 57.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.84 1.338 . . . . 0.0 111.015 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -57.33 -46.4 83.3 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.235 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.8 m -103.91 32.44 3.93 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.192 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 33.85 43.58 0.3 Allowed Glycine 0 N--CA 1.507 3.427 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.249 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.7 -13.06 59.74 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -21.1 125.56 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 117.349 2.352 . . . . 0.0 117.349 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -113.85 66.72 0.67 Allowed 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.265 -1.789 . . . . 0.0 107.008 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.2 t 50.38 29.45 3.87 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 113.281 -1.781 . . . . 0.0 113.037 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.5 -19.97 2.78 Favored Glycine 0 N--CA 1.497 2.701 0 CA-C-N 114.539 -1.209 . . . . 0.0 113.083 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HZ3' ' HD3' ' A' ' 7' ' ' LYS . 6.9 mmpt? -121.56 116.0 23.83 Favored 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.6 m -55.96 114.04 1.76 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 122.509 1.147 . . . . 0.0 113.343 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.39 0 O-C-N 119.589 -1.944 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.3 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 4.9 mptt -111.57 131.9 54.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 123.82 0.7 . . . . 0.0 111.405 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.02 175.31 54.6 Favored Glycine 0 N--CA 1.496 2.676 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.041 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -58.05 142.79 45.68 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.082 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.0 12.09 64.55 Favored Glycine 0 N--CA 1.493 2.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.372 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.22 158.28 23.61 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.041 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 tptt -74.81 83.22 2.14 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.506 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.75 -164.73 0.83 Allowed 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.602 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.07 127.85 4.67 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.092 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -15.83 62.94 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-N 113.497 -1.683 . . . . 0.0 112.208 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.6 -8.1 58.97 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.609 -0.836 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -163.74 38.42 0.09 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -4.74 63.88 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.917 0 O-C-N 125.76 1.913 . . . . 0.0 114.177 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.528 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.8 p30 -57.86 -17.59 17.29 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.279 -2.691 . . . . 0.0 115.054 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 45.2 m -58.15 144.15 41.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 124.24 0.963 . . . . 0.0 110.751 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.1 m -53.51 -45.41 69.71 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.608 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 m -110.3 37.5 2.7 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 125.059 1.474 . . . . 0.0 110.723 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.73 39.84 1.97 Allowed Glycine 0 N--CA 1.503 3.134 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.727 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.45 -13.75 59.37 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.671 -1.264 . . . . 0.0 112.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.469 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 17.8 t -35.4 120.62 0.56 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.899 1.374 . . . . 0.0 114.049 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -117.02 65.89 0.72 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.145 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 m 48.78 31.21 2.98 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 112.792 -2.003 . . . . 0.0 112.835 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -20.14 2.72 Favored Glycine 0 N--CA 1.496 2.647 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.422 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -123.21 118.39 27.5 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 34.2 m -68.04 84.84 0.23 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 122.677 1.227 . . . . 0.0 111.807 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.382 0 O-C-N 118.69 -2.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.8 mttm -108.12 143.96 36.15 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-O 121.474 0.654 . . . . 0.0 112.247 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.76 -178.13 40.9 Favored Glycine 0 N--CA 1.496 2.681 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.273 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -57.78 135.3 56.79 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.4 14.74 72.15 Favored Glycine 0 N--CA 1.495 2.591 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.833 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.35 155.53 28.39 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.97 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.73 82.16 1.15 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.726 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.547 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.9 p -80.71 -163.46 0.58 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.631 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 140.71 11.74 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.34 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -66.56 -24.51 66.37 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.276 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.409 HD23 ' H ' ' A' ' 11' ' ' LEU . 0.5 OUTLIER -95.39 -12.2 26.4 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 114.827 -1.078 . . . . 0.0 110.28 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 66.8 mtm -142.61 90.85 2.26 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 124.393 1.058 . . . . 0.0 108.214 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' A' ' 20' ' ' CYS . 6.2 m-85 -80.01 62.54 4.24 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-N 113.627 -1.624 . . . . 0.0 107.406 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -59.01 -22.9 61.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.622 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.9 m -51.91 137.88 25.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 124.327 1.017 . . . . 0.0 110.717 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -53.47 -45.37 69.53 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.809 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -108.51 34.14 3.8 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.815 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.45 45.6 1.37 Allowed Glycine 0 N--CA 1.505 3.26 0 CA-C-N 114.294 -1.321 . . . . 0.0 112.438 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.47 -13.63 59.44 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 12.1 t -28.68 130.42 0.06 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -125.52 65.91 1.16 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.082 -1.821 . . . . 0.0 106.082 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.4 m 47.55 34.39 3.5 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 112.688 -2.051 . . . . 0.0 112.36 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.77 -21.37 2.69 Favored Glycine 0 N--CA 1.493 2.5 0 CA-C-N 113.75 -1.568 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -123.31 120.15 32.22 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 118.111 0.955 . . . . 0.0 109.654 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 41.1 m -68.62 86.81 0.32 Allowed 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 122.501 1.143 . . . . 0.0 111.714 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.386 0 O-C-N 119.071 -2.268 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mmtm -123.52 145.29 48.98 Favored 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.912 0.863 . . . . 0.0 112.654 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.56 166.48 53.4 Favored Glycine 0 N--CA 1.495 2.608 0 CA-C-N 113.52 -1.673 . . . . 0.0 111.457 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.08 127.21 30.68 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 115.135 -0.533 . . . . 0.0 111.884 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.97 8.37 69.27 Favored Glycine 0 N--CA 1.494 2.533 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.001 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.9 162.42 16.13 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.066 0.46 . . . . 0.0 110.697 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -63.87 90.79 0.06 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.333 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.514 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 1.5 p -88.9 -172.02 3.53 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.793 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 128.59 4.75 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.748 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.3 mtm180 -73.3 -12.65 60.92 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.874 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 pp -91.66 -12.19 34.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 124.038 0.836 . . . . 0.0 110.445 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 14' ' ' ASP . 22.9 ptm -156.87 38.57 0.31 Allowed 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -5.35 64.39 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 126.23 1.812 . . . . 0.0 115.749 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 12' ' ' MET . 3.4 t0 -53.11 -31.97 44.9 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.128 -2.305 . . . . 0.0 112.145 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 25.6 m -52.76 134.91 36.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 124.334 1.021 . . . . 0.0 112.149 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.5 m -55.87 -45.52 78.49 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-N 114.206 -1.361 . . . . 0.0 112.28 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 m -108.01 36.47 2.77 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 124.784 1.303 . . . . 0.0 111.065 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.78 43.23 1.19 Allowed Glycine 0 N--CA 1.505 3.267 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.608 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.61 -14.41 58.83 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.4 t -25.08 113.29 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.42 67.77 0.65 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.602 -1.636 . . . . 0.0 107.538 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 t 50.05 28.77 3.13 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 112.361 -2.199 . . . . 0.0 113.247 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.42 -16.87 2.9 Favored Glycine 0 N--CA 1.495 2.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 113.457 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 mttm -128.92 116.0 18.71 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 90.6 m -58.09 86.09 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.294 0 O-C-N 118.628 -2.545 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.9 p . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -111.59 138.04 48.65 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 121.479 0.657 . . . . 0.0 111.632 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.0 158.67 49.93 Favored Glycine 0 N--CA 1.494 2.555 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.955 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -63.89 110.91 2.26 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.919 -0.64 . . . . 0.0 110.784 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.63 16.6 9.23 Favored Glycine 0 N--CA 1.493 2.448 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.458 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -95.15 166.14 12.06 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 124.162 0.566 . . . . 0.0 110.604 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -75.22 83.99 2.4 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.016 -0.993 . . . . 0.0 109.799 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.423 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.22 -157.69 0.18 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.832 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.48 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -158.0 139.22 13.41 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.6 ptt180 -60.37 -32.25 71.12 Favored 'General case' 0 N--CA 1.5 2.025 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.478 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.71 8.0 45.26 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.407 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttp -150.19 95.23 2.25 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -83.05 56.94 3.68 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.027 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -24.63 60.98 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.828 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.9 m -54.8 141.26 33.52 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 124.454 1.096 . . . . 0.0 111.663 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.6 m -54.29 -45.32 72.49 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.937 -1.483 . . . . 0.0 112.351 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -108.27 37.5 2.47 Favored 'General case' 0 N--CA 1.499 2.001 0 CA-C-N 114.13 -1.396 . . . . 0.0 110.758 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.0 42.58 1.18 Allowed Glycine 0 N--CA 1.504 3.229 0 CA-C-N 114.482 -1.235 . . . . 0.0 112.544 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.48 -14.71 58.71 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.997 -1.102 . . . . 0.0 113.199 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' O ' ' A' ' 9' ' ' SER . 40.7 t -33.17 122.55 0.39 Allowed 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -117.27 66.1 0.73 Allowed 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 113.458 -1.701 . . . . 0.0 107.753 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.1 p 44.3 36.16 1.5 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 112.793 -2.003 . . . . 0.0 112.9 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.85 -18.75 2.75 Favored Glycine 0 N--CA 1.496 2.644 0 CA-C-N 112.987 -1.915 . . . . 0.0 113.735 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 tttm -129.82 116.57 18.91 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-N 117.762 0.781 . . . . 0.0 110.115 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.458 ' HB2' ' H ' ' A' ' 6' ' ' ALA . 56.5 m -65.28 90.65 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 122.87 1.319 . . . . 0.0 111.438 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.344 0 O-C-N 118.743 -2.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.504 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.51 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m -69.89 135.91 50.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 119.628 -1.92 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.0 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.58 130.29 56.07 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 123.77 0.669 . . . . 0.0 111.977 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.31 -176.49 46.87 Favored Glycine 0 N--CA 1.497 2.752 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.071 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.16 138.45 49.9 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.14 15.05 49.47 Favored Glycine 0 N--CA 1.495 2.57 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.056 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.59 153.64 23.09 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.722 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -64.28 94.17 0.11 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 114.477 -1.238 . . . . 0.0 109.539 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.58 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 5.1 p -91.05 -170.04 2.54 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.731 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.13 125.03 3.88 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-N 113.919 -1.491 . . . . 0.0 107.828 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.401 ' NE ' ' H ' ' A' ' 22' ' ' SER . 96.8 mtt180 -75.42 -15.87 60.4 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 113.532 -1.667 . . . . 0.0 109.837 -179.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.417 ' N ' HD12 ' A' ' 11' ' ' LEU . 9.1 mp -75.95 -15.19 60.21 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.928 -1.033 . . . . 0.0 108.846 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' ASP . 7.5 ptp -164.52 50.89 0.12 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.071 0.857 . . . . 0.0 110.45 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -7.33 66.28 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.509 0 O-C-N 125.572 1.795 . . . . 0.0 114.947 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' MET . 0.5 OUTLIER -50.47 -28.58 8.59 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 110.829 -2.896 . . . . 0.0 113.025 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.444 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 55.5 m -60.7 140.06 57.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 124.772 1.295 . . . . 0.0 111.091 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.4 m -54.61 -45.49 73.69 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-N 114.19 -1.368 . . . . 0.0 112.231 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 m -112.47 38.57 2.7 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.646 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.08 43.76 1.9 Allowed Glycine 0 N--CA 1.503 3.144 0 CA-C-N 114.531 -1.213 . . . . 0.0 112.817 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -12.18 59.82 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.319 -0.941 . . . . 0.0 113.044 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -31.03 120.96 0.22 Allowed 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -119.09 69.83 0.82 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.401 ' H ' ' NE ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 52.47 24.39 2.99 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.884 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -12.9 2.88 Favored Glycine 0 N--CA 1.496 2.651 0 CA-C-O 118.681 -1.066 . . . . 0.0 113.065 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.8 mmtm -125.89 119.64 28.33 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 68.4 m -67.05 84.54 0.13 Allowed 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 122.603 1.192 . . . . 0.0 113.414 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.407 0 O-C-N 119.039 -2.288 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.9 p . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -107.64 141.21 39.48 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.439 0.637 . . . . 0.0 111.48 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.01 161.59 54.12 Favored Glycine 0 N--CA 1.497 2.757 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.684 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -70.69 111.83 6.46 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 0.0 111.113 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.96 15.66 19.39 Favored Glycine 0 N--CA 1.494 2.511 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.791 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.35 163.88 13.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.343 0.672 . . . . 0.0 110.348 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -65.3 104.23 0.91 Allowed 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.0 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.4 p -102.26 -161.53 0.86 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.249 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.48 140.99 11.63 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.559 0.537 . . . . 0.0 109.675 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 mtm180 -63.87 -28.24 69.71 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.65 -8.44 34.78 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.877 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -144.42 91.35 2.18 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 124.04 0.838 . . . . 0.0 109.359 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -81.0 60.02 4.03 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 113.23 -1.805 . . . . 0.0 107.772 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.73 -23.66 60.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.661 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.4 m -47.71 135.27 11.94 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 124.565 1.165 . . . . 0.0 111.71 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.56 -41.89 63.95 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 114.099 -1.409 . . . . 0.0 111.908 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.6 m -111.24 36.8 3.06 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 125.04 1.462 . . . . 0.0 111.586 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 34.61 41.94 0.28 Allowed Glycine 0 N--CA 1.509 3.557 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.77 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.84 -12.52 59.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -26.87 121.32 0.09 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -119.59 65.31 0.8 Allowed 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 113.527 -1.669 . . . . 0.0 107.57 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 7.6 t 49.93 27.75 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 112.761 -2.018 . . . . 0.0 113.414 179.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.59 -9.91 2.9 Favored Glycine 0 N--CA 1.496 2.64 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.503 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.03 113.29 13.77 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 55.3 m -65.11 86.11 0.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 122.717 1.246 . . . . 0.0 112.048 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.346 0 O-C-N 118.762 -2.461 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.2 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -120.38 154.56 34.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-O 121.76 0.791 . . . . 0.0 112.936 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.59 179.96 46.23 Favored Glycine 0 N--CA 1.497 2.74 0 CA-C-N 113.723 -1.581 . . . . 0.0 112.694 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -57.8 138.96 55.09 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 67.79 12.4 62.06 Favored Glycine 0 N--CA 1.495 2.585 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.128 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.427 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -73.47 164.04 27.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 76.81 6.4 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.163 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.29 -157.79 0.19 Allowed 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.35 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.502 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 46.7 t -161.02 159.55 29.5 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.638 1.208 . . . . 0.0 110.211 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -33.77 76.53 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 112.321 -2.218 . . . . 0.0 109.313 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.04 1.3 49.98 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.434 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 36.3 mtp -143.39 92.56 2.38 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.953 0.882 . . . . 0.0 111.138 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -86.78 55.65 3.66 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -13.88 61.95 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.326 -1.761 . . . . 0.0 115.027 -179.426 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.511 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.1 m -56.14 143.79 31.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 123.931 0.77 . . . . 0.0 110.342 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.3 m -56.4 -45.15 80.76 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.366 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.5 t -104.51 34.0 3.31 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 124.812 1.32 . . . . 0.0 111.522 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.2 41.43 2.11 Favored Glycine 0 N--CA 1.502 3.044 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.066 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.54 -12.78 59.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.849 -1.175 . . . . 0.0 113.349 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.511 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 33.9 t -35.83 132.87 0.46 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -129.95 62.44 1.56 Allowed 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 112.911 -1.95 . . . . 0.0 107.829 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.3 m 43.13 41.66 2.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.928 -1.942 . . . . 0.0 111.946 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.34 2.28 Favored Glycine 0 N--CA 1.493 2.442 0 CA-C-N 112.946 -1.934 . . . . 0.0 113.29 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -121.65 124.98 45.6 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.014 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.568 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 11.4 m -75.56 72.95 2.56 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.534 1.159 . . . . 0.0 111.418 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.365 0 O-C-N 118.523 -2.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.8 p . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -110.17 123.59 50.02 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 123.563 0.539 . . . . 0.0 109.851 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -68.93 169.45 42.5 Favored Glycine 0 N--CA 1.499 2.875 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.385 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.26 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 121.375 0.607 . . . . 0.0 112.061 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 109.43 21.13 7.41 Favored Glycine 0 N--CA 1.494 2.541 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.075 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.442 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -91.94 153.32 19.56 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -70.43 84.37 0.59 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 124.188 0.93 . . . . 0.0 108.678 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.494 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -79.79 -159.78 0.23 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.738 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.23 142.2 12.85 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.309 0.576 . . . . 0.0 110.109 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 ptt85 -62.89 -29.95 71.16 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.253 -1.339 . . . . 0.0 109.564 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.58 -1.85 42.97 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.738 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.0 mmm -147.8 92.77 2.11 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 124.1 0.875 . . . . 0.0 108.831 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -81.99 60.82 5.0 Favored 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 113.607 -1.633 . . . . 0.0 107.637 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -13.59 33.5 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.231 -1.35 . . . . 0.0 113.218 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.2 m -56.74 142.13 41.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.908 0.755 . . . . 0.0 111.496 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -51.44 -43.29 62.01 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.46 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.6 m -118.22 36.46 4.35 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.73 46.4 2.96 Favored Glycine 0 N--CA 1.503 3.117 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.317 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.29 -14.28 59.12 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 114.213 -0.993 . . . . 0.0 113.091 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.9 t -28.25 120.58 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 115.971 1.841 . . . . 0.0 115.971 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -116.35 67.66 0.72 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.291 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.4 m 49.81 28.88 2.95 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 112.958 -1.928 . . . . 0.0 113.125 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.75 -14.23 2.9 Favored Glycine 0 N--CA 1.495 2.614 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.974 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -129.03 112.33 13.91 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.8 m -61.73 95.09 0.05 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 122.676 1.227 . . . . 0.0 111.662 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.396 0 O-C-N 118.861 -2.399 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.504 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.51 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m . . . . . 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -108.58 144.34 36.41 Favored 'General case' 0 N--CA 1.501 2.088 0 CA-C-O 121.459 0.647 . . . . 0.0 112.559 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -90.91 176.82 41.23 Favored Glycine 0 N--CA 1.496 2.668 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.383 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.8 mmtt -60.44 132.53 54.21 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.473 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.36 16.54 79.35 Favored Glycine 0 N--CA 1.493 2.47 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.563 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.65 161.31 19.31 Favored 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.49 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.8 tttt -77.0 80.69 3.53 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.946 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.525 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -79.91 -159.94 0.24 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.361 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.44 139.43 10.54 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.688 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -26.97 67.99 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.396 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.43 -13.47 23.13 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.903 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mmm -141.75 91.74 2.39 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 124.087 0.867 . . . . 0.0 108.699 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -81.56 62.46 5.43 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.185 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.63 -18.45 30.58 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 113.966 -1.47 . . . . 0.0 113.402 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.3 m -51.58 138.32 22.86 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 124.26 0.975 . . . . 0.0 111.407 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 m -54.69 -45.96 74.05 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 114.305 -1.316 . . . . 0.0 112.38 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 m -108.66 37.57 2.49 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.077 -1.42 . . . . 0.0 111.041 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.8 45.64 1.56 Allowed Glycine 0 N--CA 1.503 3.162 0 CA-C-N 114.642 -1.163 . . . . 0.0 112.182 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -14.12 59.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 113.96 -1.12 . . . . 0.0 112.841 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -31.86 130.01 0.16 Allowed 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -126.44 64.31 1.26 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.594 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m 47.25 34.92 3.37 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 112.641 -2.072 . . . . 0.0 112.314 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -23.01 2.63 Favored Glycine 0 N--CA 1.493 2.485 0 CA-C-N 113.791 -1.55 . . . . 0.0 113.119 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -122.46 120.6 34.39 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.867 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.525 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 50.9 m . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 122.622 1.201 . . . . 0.0 111.463 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.8 p . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -112.26 137.91 49.71 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-O 121.524 0.678 . . . . 0.0 112.607 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.0 -170.88 46.68 Favored Glycine 0 N--CA 1.498 2.787 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.62 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -59.13 135.14 57.54 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.93 12.53 43.26 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.833 -1.076 . . . . 0.0 113.225 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.57 153.61 42.71 Favored 'General case' 0 N--CA 1.496 1.875 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.778 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -65.74 91.07 0.13 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 123.937 0.773 . . . . 0.0 111.121 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -92.89 -167.46 1.74 Allowed 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.128 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -160.25 143.01 13.39 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.466 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -64.29 -26.61 68.56 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.986 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 tp -95.96 -8.92 32.49 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.108 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.7 mtm -142.14 92.4 2.43 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -80.13 60.46 3.65 Favored 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 113.205 -1.816 . . . . 0.0 108.704 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -57.21 -27.97 62.46 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.638 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.0 m -49.74 136.28 17.83 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.462 1.101 . . . . 0.0 111.842 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -53.73 -43.78 69.34 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.26 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 m -114.8 39.7 2.79 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 114.039 -1.437 . . . . 0.0 111.309 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.9 45.48 1.6 Allowed Glycine 0 N--CA 1.506 3.334 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.717 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -11.63 59.88 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.055 -1.073 . . . . 0.0 113.488 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -28.58 133.04 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 116.042 1.868 . . . . 0.0 116.042 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 ttm105 -132.65 60.19 1.7 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 113.139 -1.846 . . . . 0.0 106.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.8 p 42.7 39.63 1.72 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-N 112.705 -2.043 . . . . 0.0 112.546 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.08 -18.5 2.71 Favored Glycine 0 N--CA 1.493 2.453 0 CA-C-N 112.605 -2.089 . . . . 0.0 112.827 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -130.36 121.98 27.01 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.28 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 30.7 m . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 122.387 1.089 . . . . 0.0 111.117 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.6 p . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -127.03 148.73 50.11 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -94.95 171.63 30.19 Favored Glycine 0 N--CA 1.494 2.507 0 CA-C-N 113.93 -1.486 . . . . 0.0 110.818 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -52.48 137.85 28.95 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 114.61 -0.795 . . . . 0.0 111.875 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.57 12.29 84.39 Favored Glycine 0 N--CA 1.492 2.407 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.665 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.18 167.15 11.54 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.366 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.422 ' HD3' ' HZ3' ' A' ' 24' ' ' LYS . 1.3 mppt? -76.47 86.63 3.2 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.884 0.85 . . . . 0.0 110.167 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.597 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 7.1 p -86.2 -170.81 3.26 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 114.163 -1.38 . . . . 0.0 112.857 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -159.95 125.22 4.02 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.89 -1.504 . . . . 0.0 107.843 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.4 -7.8 54.13 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.024 -1.444 . . . . 0.0 110.881 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.5 tp -95.21 -22.42 17.83 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.533 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' N ' ' A' ' 14' ' ' ASP . 69.5 mmm -144.36 42.37 1.39 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 123.863 0.727 . . . . 0.0 110.879 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -8.35 66.94 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 125.977 1.711 . . . . 0.0 115.017 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.3 t70 -50.45 -32.05 16.86 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 110.779 -2.919 . . . . 0.0 112.455 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 6.9 m -62.84 143.21 57.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.84 1.338 . . . . 0.0 111.015 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -57.33 -46.4 83.3 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.235 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.8 m -103.91 32.44 3.93 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.192 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 33.85 43.58 0.3 Allowed Glycine 0 N--CA 1.507 3.427 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.249 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.7 -13.06 59.74 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -21.1 125.56 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 117.349 2.352 . . . . 0.0 117.349 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -113.85 66.72 0.67 Allowed 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.265 -1.789 . . . . 0.0 107.008 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.2 t 50.38 29.45 3.87 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 113.281 -1.781 . . . . 0.0 113.037 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.5 -19.97 2.78 Favored Glycine 0 N--CA 1.497 2.701 0 CA-C-N 114.539 -1.209 . . . . 0.0 113.083 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HZ3' ' HD3' ' A' ' 7' ' ' LYS . 6.9 mmpt? -121.56 116.0 23.83 Favored 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.6 m . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 122.509 1.147 . . . . 0.0 113.343 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.3 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 4.9 mptt -111.57 131.9 54.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 123.82 0.7 . . . . 0.0 111.405 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.02 175.31 54.6 Favored Glycine 0 N--CA 1.496 2.676 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.041 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -58.05 142.79 45.68 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.082 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.0 12.09 64.55 Favored Glycine 0 N--CA 1.493 2.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.372 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.22 158.28 23.61 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.041 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 tptt -74.81 83.22 2.14 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.506 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.75 -164.73 0.83 Allowed 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.602 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.07 127.85 4.67 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.092 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -15.83 62.94 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-N 113.497 -1.683 . . . . 0.0 112.208 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.6 -8.1 58.97 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.609 -0.836 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -163.74 38.42 0.09 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -4.74 63.88 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.917 0 O-C-N 125.76 1.913 . . . . 0.0 114.177 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.528 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.8 p30 -57.86 -17.59 17.29 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.279 -2.691 . . . . 0.0 115.054 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 45.2 m -58.15 144.15 41.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 124.24 0.963 . . . . 0.0 110.751 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.1 m -53.51 -45.41 69.71 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.608 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 m -110.3 37.5 2.7 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 125.059 1.474 . . . . 0.0 110.723 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.73 39.84 1.97 Allowed Glycine 0 N--CA 1.503 3.134 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.727 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.45 -13.75 59.37 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.671 -1.264 . . . . 0.0 112.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.469 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 17.8 t -35.4 120.62 0.56 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.899 1.374 . . . . 0.0 114.049 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -117.02 65.89 0.72 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.145 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 m 48.78 31.21 2.98 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 112.792 -2.003 . . . . 0.0 112.835 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -20.14 2.72 Favored Glycine 0 N--CA 1.496 2.647 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.422 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -123.21 118.39 27.5 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 34.2 m . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 122.677 1.227 . . . . 0.0 111.807 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.8 mttm -108.12 143.96 36.15 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-O 121.474 0.654 . . . . 0.0 112.247 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.76 -178.13 40.9 Favored Glycine 0 N--CA 1.496 2.681 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.273 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -57.78 135.3 56.79 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.4 14.74 72.15 Favored Glycine 0 N--CA 1.495 2.591 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.833 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.35 155.53 28.39 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.97 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.73 82.16 1.15 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.726 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.547 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.9 p -80.71 -163.46 0.58 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.631 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 140.71 11.74 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.34 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -66.56 -24.51 66.37 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.276 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.409 HD23 ' H ' ' A' ' 11' ' ' LEU . 0.5 OUTLIER -95.39 -12.2 26.4 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 114.827 -1.078 . . . . 0.0 110.28 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 66.8 mtm -142.61 90.85 2.26 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 124.393 1.058 . . . . 0.0 108.214 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' A' ' 20' ' ' CYS . 6.2 m-85 -80.01 62.54 4.24 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-N 113.627 -1.624 . . . . 0.0 107.406 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -59.01 -22.9 61.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.622 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.9 m -51.91 137.88 25.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 124.327 1.017 . . . . 0.0 110.717 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -53.47 -45.37 69.53 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.809 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -108.51 34.14 3.8 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.815 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.45 45.6 1.37 Allowed Glycine 0 N--CA 1.505 3.26 0 CA-C-N 114.294 -1.321 . . . . 0.0 112.438 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.47 -13.63 59.44 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 12.1 t -28.68 130.42 0.06 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -125.52 65.91 1.16 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.082 -1.821 . . . . 0.0 106.082 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.4 m 47.55 34.39 3.5 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 112.688 -2.051 . . . . 0.0 112.36 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.77 -21.37 2.69 Favored Glycine 0 N--CA 1.493 2.5 0 CA-C-N 113.75 -1.568 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -123.31 120.15 32.22 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 118.111 0.955 . . . . 0.0 109.654 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 41.1 m . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 122.501 1.143 . . . . 0.0 111.714 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mmtm -123.52 145.29 48.98 Favored 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.912 0.863 . . . . 0.0 112.654 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.56 166.48 53.4 Favored Glycine 0 N--CA 1.495 2.608 0 CA-C-N 113.52 -1.673 . . . . 0.0 111.457 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.08 127.21 30.68 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 115.135 -0.533 . . . . 0.0 111.884 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.97 8.37 69.27 Favored Glycine 0 N--CA 1.494 2.533 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.001 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.9 162.42 16.13 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.066 0.46 . . . . 0.0 110.697 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -63.87 90.79 0.06 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.333 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.514 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 1.5 p -88.9 -172.02 3.53 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.793 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 128.59 4.75 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.748 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.3 mtm180 -73.3 -12.65 60.92 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.874 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 pp -91.66 -12.19 34.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 124.038 0.836 . . . . 0.0 110.445 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 14' ' ' ASP . 22.9 ptm -156.87 38.57 0.31 Allowed 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -5.35 64.39 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 126.23 1.812 . . . . 0.0 115.749 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 12' ' ' MET . 3.4 t0 -53.11 -31.97 44.9 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.128 -2.305 . . . . 0.0 112.145 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 25.6 m -52.76 134.91 36.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 124.334 1.021 . . . . 0.0 112.149 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.5 m -55.87 -45.52 78.49 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-N 114.206 -1.361 . . . . 0.0 112.28 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 m -108.01 36.47 2.77 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 124.784 1.303 . . . . 0.0 111.065 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.78 43.23 1.19 Allowed Glycine 0 N--CA 1.505 3.267 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.608 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.61 -14.41 58.83 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.4 t -25.08 113.29 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.42 67.77 0.65 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.602 -1.636 . . . . 0.0 107.538 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 t 50.05 28.77 3.13 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 112.361 -2.199 . . . . 0.0 113.247 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.42 -16.87 2.9 Favored Glycine 0 N--CA 1.495 2.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 113.457 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 mttm -128.92 116.0 18.71 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 90.6 m . . . . . 0 N--CA 1.496 1.874 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.9 p . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -111.59 138.04 48.65 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 121.479 0.657 . . . . 0.0 111.632 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.0 158.67 49.93 Favored Glycine 0 N--CA 1.494 2.555 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.955 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -63.89 110.91 2.26 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.919 -0.64 . . . . 0.0 110.784 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.63 16.6 9.23 Favored Glycine 0 N--CA 1.493 2.448 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.458 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -95.15 166.14 12.06 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 124.162 0.566 . . . . 0.0 110.604 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -75.22 83.99 2.4 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.016 -0.993 . . . . 0.0 109.799 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.423 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.22 -157.69 0.18 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.832 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.48 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -158.0 139.22 13.41 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.6 ptt180 -60.37 -32.25 71.12 Favored 'General case' 0 N--CA 1.5 2.025 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.478 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.71 8.0 45.26 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.407 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttp -150.19 95.23 2.25 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -83.05 56.94 3.68 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.027 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -24.63 60.98 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.828 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.9 m -54.8 141.26 33.52 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 124.454 1.096 . . . . 0.0 111.663 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.6 m -54.29 -45.32 72.49 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.937 -1.483 . . . . 0.0 112.351 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -108.27 37.5 2.47 Favored 'General case' 0 N--CA 1.499 2.001 0 CA-C-N 114.13 -1.396 . . . . 0.0 110.758 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.0 42.58 1.18 Allowed Glycine 0 N--CA 1.504 3.229 0 CA-C-N 114.482 -1.235 . . . . 0.0 112.544 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.48 -14.71 58.71 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.997 -1.102 . . . . 0.0 113.199 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' O ' ' A' ' 9' ' ' SER . 40.7 t -33.17 122.55 0.39 Allowed 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -117.27 66.1 0.73 Allowed 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 113.458 -1.701 . . . . 0.0 107.753 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.1 p 44.3 36.16 1.5 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 112.793 -2.003 . . . . 0.0 112.9 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.85 -18.75 2.75 Favored Glycine 0 N--CA 1.496 2.644 0 CA-C-N 112.987 -1.915 . . . . 0.0 113.735 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 tttm -129.82 116.57 18.91 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-N 117.762 0.781 . . . . 0.0 110.115 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.458 ' HB2' ' H ' ' A' ' 6' ' ' ALA . 56.5 m . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 122.87 1.319 . . . . 0.0 111.438 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.504 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.51 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m . . . . . 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.0 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.58 130.29 56.07 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 123.77 0.669 . . . . 0.0 111.977 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.31 -176.49 46.87 Favored Glycine 0 N--CA 1.497 2.752 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.071 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.16 138.45 49.9 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.14 15.05 49.47 Favored Glycine 0 N--CA 1.495 2.57 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.056 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.59 153.64 23.09 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.722 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -64.28 94.17 0.11 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 114.477 -1.238 . . . . 0.0 109.539 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.58 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 5.1 p -91.05 -170.04 2.54 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.731 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.13 125.03 3.88 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-N 113.919 -1.491 . . . . 0.0 107.828 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.401 ' NE ' ' H ' ' A' ' 22' ' ' SER . 96.8 mtt180 -75.42 -15.87 60.4 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 113.532 -1.667 . . . . 0.0 109.837 -179.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.417 ' N ' HD12 ' A' ' 11' ' ' LEU . 9.1 mp -75.95 -15.19 60.21 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.928 -1.033 . . . . 0.0 108.846 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' ASP . 7.5 ptp -164.52 50.89 0.12 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.071 0.857 . . . . 0.0 110.45 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -7.33 66.28 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.509 0 O-C-N 125.572 1.795 . . . . 0.0 114.947 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' MET . 0.5 OUTLIER -50.47 -28.58 8.59 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 110.829 -2.896 . . . . 0.0 113.025 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.444 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 55.5 m -60.7 140.06 57.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 124.772 1.295 . . . . 0.0 111.091 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.4 m -54.61 -45.49 73.69 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-N 114.19 -1.368 . . . . 0.0 112.231 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 m -112.47 38.57 2.7 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.646 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.08 43.76 1.9 Allowed Glycine 0 N--CA 1.503 3.144 0 CA-C-N 114.531 -1.213 . . . . 0.0 112.817 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -12.18 59.82 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.319 -0.941 . . . . 0.0 113.044 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -31.03 120.96 0.22 Allowed 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -119.09 69.83 0.82 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.401 ' H ' ' NE ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 52.47 24.39 2.99 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.884 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -12.9 2.88 Favored Glycine 0 N--CA 1.496 2.651 0 CA-C-O 118.681 -1.066 . . . . 0.0 113.065 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.8 mmtm -125.89 119.64 28.33 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 68.4 m . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 122.603 1.192 . . . . 0.0 113.414 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.9 p . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -107.64 141.21 39.48 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.439 0.637 . . . . 0.0 111.48 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.01 161.59 54.12 Favored Glycine 0 N--CA 1.497 2.757 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.684 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -70.69 111.83 6.46 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 0.0 111.113 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.96 15.66 19.39 Favored Glycine 0 N--CA 1.494 2.511 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.791 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.35 163.88 13.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.343 0.672 . . . . 0.0 110.348 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -65.3 104.23 0.91 Allowed 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.0 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.4 p -102.26 -161.53 0.86 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.249 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.48 140.99 11.63 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.559 0.537 . . . . 0.0 109.675 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 mtm180 -63.87 -28.24 69.71 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.65 -8.44 34.78 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.877 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -144.42 91.35 2.18 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 124.04 0.838 . . . . 0.0 109.359 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -81.0 60.02 4.03 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 113.23 -1.805 . . . . 0.0 107.772 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.73 -23.66 60.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.661 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.4 m -47.71 135.27 11.94 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 124.565 1.165 . . . . 0.0 111.71 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.56 -41.89 63.95 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 114.099 -1.409 . . . . 0.0 111.908 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.6 m -111.24 36.8 3.06 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 125.04 1.462 . . . . 0.0 111.586 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 34.61 41.94 0.28 Allowed Glycine 0 N--CA 1.509 3.557 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.77 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.84 -12.52 59.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -26.87 121.32 0.09 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -119.59 65.31 0.8 Allowed 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 113.527 -1.669 . . . . 0.0 107.57 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 7.6 t 49.93 27.75 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 112.761 -2.018 . . . . 0.0 113.414 179.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.59 -9.91 2.9 Favored Glycine 0 N--CA 1.496 2.64 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.503 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.03 113.29 13.77 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 55.3 m . . . . . 0 N--CA 1.494 1.738 0 CA-C-O 122.717 1.246 . . . . 0.0 112.048 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.2 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -120.38 154.56 34.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-O 121.76 0.791 . . . . 0.0 112.936 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.59 179.96 46.23 Favored Glycine 0 N--CA 1.497 2.74 0 CA-C-N 113.723 -1.581 . . . . 0.0 112.694 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -57.8 138.96 55.09 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 67.79 12.4 62.06 Favored Glycine 0 N--CA 1.495 2.585 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.128 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.427 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -73.47 164.04 27.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 76.81 6.4 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.163 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.29 -157.79 0.19 Allowed 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.35 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.502 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 46.7 t -161.02 159.55 29.5 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.638 1.208 . . . . 0.0 110.211 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -33.77 76.53 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 112.321 -2.218 . . . . 0.0 109.313 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.04 1.3 49.98 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.434 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 36.3 mtp -143.39 92.56 2.38 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.953 0.882 . . . . 0.0 111.138 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -86.78 55.65 3.66 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -13.88 61.95 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.326 -1.761 . . . . 0.0 115.027 -179.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.511 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.1 m -56.14 143.79 31.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 123.931 0.77 . . . . 0.0 110.342 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.3 m -56.4 -45.15 80.76 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.366 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.5 t -104.51 34.0 3.31 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 124.812 1.32 . . . . 0.0 111.522 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.2 41.43 2.11 Favored Glycine 0 N--CA 1.502 3.044 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.066 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.54 -12.78 59.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.849 -1.175 . . . . 0.0 113.349 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.511 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 33.9 t -35.83 132.87 0.46 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -129.95 62.44 1.56 Allowed 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 112.911 -1.95 . . . . 0.0 107.829 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.3 m 43.13 41.66 2.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.928 -1.942 . . . . 0.0 111.946 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.34 2.28 Favored Glycine 0 N--CA 1.493 2.442 0 CA-C-N 112.946 -1.934 . . . . 0.0 113.29 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -121.65 124.98 45.6 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.014 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.568 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 11.4 m . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 122.534 1.159 . . . . 0.0 111.418 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.8 p . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -110.17 123.59 50.02 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 123.563 0.539 . . . . 0.0 109.851 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -68.93 169.45 42.5 Favored Glycine 0 N--CA 1.499 2.875 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.385 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.26 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 121.375 0.607 . . . . 0.0 112.061 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 109.43 21.13 7.41 Favored Glycine 0 N--CA 1.494 2.541 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.075 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.442 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -91.94 153.32 19.56 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -70.43 84.37 0.59 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 124.188 0.93 . . . . 0.0 108.678 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.494 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -79.79 -159.78 0.23 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.738 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.23 142.2 12.85 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.309 0.576 . . . . 0.0 110.109 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 ptt85 -62.89 -29.95 71.16 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.253 -1.339 . . . . 0.0 109.564 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.58 -1.85 42.97 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.738 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.0 mmm -147.8 92.77 2.11 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 124.1 0.875 . . . . 0.0 108.831 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -81.99 60.82 5.0 Favored 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 113.607 -1.633 . . . . 0.0 107.637 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -13.59 33.5 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.231 -1.35 . . . . 0.0 113.218 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.2 m -56.74 142.13 41.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.908 0.755 . . . . 0.0 111.496 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -51.44 -43.29 62.01 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.46 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.6 m -118.22 36.46 4.35 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.73 46.4 2.96 Favored Glycine 0 N--CA 1.503 3.117 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.317 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.29 -14.28 59.12 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 114.213 -0.993 . . . . 0.0 113.091 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.9 t -28.25 120.58 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 115.971 1.841 . . . . 0.0 115.971 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -116.35 67.66 0.72 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.291 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.4 m 49.81 28.88 2.95 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 112.958 -1.928 . . . . 0.0 113.125 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.75 -14.23 2.9 Favored Glycine 0 N--CA 1.495 2.614 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.974 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -129.03 112.33 13.91 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.8 m . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 122.676 1.227 . . . . 0.0 111.662 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.504 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.51 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m -69.89 135.91 50.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 119.628 -1.92 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m -64.76 81.81 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.329 0 O-C-N 118.707 -2.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.5 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -120.59 150.85 40.23 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.466 0.651 . . . . 0.0 112.039 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.31 178.56 44.66 Favored Glycine 0 N--CA 1.496 2.694 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.695 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.0 pttt -58.12 142.12 48.12 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.512 -0.844 . . . . 0.0 112.621 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.5 11.98 54.73 Favored Glycine 0 N--CA 1.494 2.56 0 CA-C-N 114.814 -1.085 . . . . 0.0 112.621 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 158.58 29.89 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.705 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.3 mmtp -70.17 87.54 0.59 Allowed 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.981 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -85.65 -165.24 1.17 Allowed 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.17 -179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.49 143.1 13.08 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.694 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -62.92 -28.7 70.24 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.707 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.38 -9.2 30.52 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.131 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 4.4 mmm -145.09 91.09 2.1 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.718 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -82.11 62.78 6.02 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.578 -1.646 . . . . 0.0 106.65 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -53.1 -26.49 16.65 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.102 -1.408 . . . . 0.0 112.677 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.3 m -49.15 136.02 15.67 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 124.787 1.304 . . . . 0.0 111.522 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -56.97 -46.77 81.96 Favored 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.743 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -102.61 33.15 3.29 Favored 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.484 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.21 45.74 1.8 Allowed Glycine 0 N--CA 1.504 3.208 0 CA-C-N 114.238 -1.346 . . . . 0.0 112.093 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.62 -13.66 59.35 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 114.017 -1.092 . . . . 0.0 113.854 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -26.63 120.51 0.08 Allowed 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 115.302 1.593 . . . . 0.0 115.302 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.0 ttt180 -120.04 65.64 0.82 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 113.738 -1.574 . . . . 0.0 107.964 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 m 49.05 31.61 3.48 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.43 -2.168 . . . . 0.0 113.104 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -19.71 2.73 Favored Glycine 0 N--CA 1.495 2.609 0 CA-C-N 114.168 -1.378 . . . . 0.0 112.935 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -126.91 118.62 24.92 Favored 'General case' 0 N--CA 1.502 2.172 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.7 m -64.76 81.81 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.543 1.163 . . . . 0.0 112.838 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.329 0 O-C-N 118.707 -2.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -108.58 144.34 36.41 Favored 'General case' 0 N--CA 1.501 2.088 0 CA-C-O 121.459 0.647 . . . . 0.0 112.559 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -90.91 176.82 41.23 Favored Glycine 0 N--CA 1.496 2.668 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.383 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.8 mmtt -60.44 132.53 54.21 Favored 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.473 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.36 16.54 79.35 Favored Glycine 0 N--CA 1.493 2.47 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.563 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.65 161.31 19.31 Favored 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.49 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.8 tttt -77.0 80.69 3.53 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.946 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.525 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -79.91 -159.94 0.24 Allowed 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.361 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.44 139.43 10.54 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.688 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -26.97 67.99 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.396 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.43 -13.47 23.13 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.903 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mmm -141.75 91.74 2.39 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 124.087 0.867 . . . . 0.0 108.699 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -81.56 62.46 5.43 Favored 'General case' 0 N--CA 1.5 2.066 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.185 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -58.63 -18.45 30.58 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 113.966 -1.47 . . . . 0.0 113.402 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.3 m -51.58 138.32 22.86 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 124.26 0.975 . . . . 0.0 111.407 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.0 m -54.69 -45.96 74.05 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 114.305 -1.316 . . . . 0.0 112.38 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 m -108.66 37.57 2.49 Favored 'General case' 0 N--CA 1.5 2.026 0 CA-C-N 114.077 -1.42 . . . . 0.0 111.041 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.8 45.64 1.56 Allowed Glycine 0 N--CA 1.503 3.162 0 CA-C-N 114.642 -1.163 . . . . 0.0 112.182 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -14.12 59.17 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 113.96 -1.12 . . . . 0.0 112.841 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -31.86 130.01 0.16 Allowed 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -126.44 64.31 1.26 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 113.173 -1.83 . . . . 0.0 106.594 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m 47.25 34.92 3.37 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 112.641 -2.072 . . . . 0.0 112.314 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -23.01 2.63 Favored Glycine 0 N--CA 1.493 2.485 0 CA-C-N 113.791 -1.55 . . . . 0.0 113.119 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -122.46 120.6 34.39 Favored 'General case' 0 N--CA 1.505 2.309 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.867 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.525 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 50.9 m -69.29 84.94 0.39 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 122.622 1.201 . . . . 0.0 111.463 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.401 0 O-C-N 118.741 -2.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.8 p . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -112.26 137.91 49.71 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-O 121.524 0.678 . . . . 0.0 112.607 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.0 -170.88 46.68 Favored Glycine 0 N--CA 1.498 2.787 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.62 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -59.13 135.14 57.54 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.93 12.53 43.26 Favored Glycine 0 N--CA 1.497 2.742 0 CA-C-N 114.833 -1.076 . . . . 0.0 113.225 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.57 153.61 42.71 Favored 'General case' 0 N--CA 1.496 1.875 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.778 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -65.74 91.07 0.13 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 123.937 0.773 . . . . 0.0 111.121 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -92.89 -167.46 1.74 Allowed 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.128 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -160.25 143.01 13.39 Favored 'General case' 0 N--CA 1.499 2.025 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.466 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -64.29 -26.61 68.56 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.986 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 tp -95.96 -8.92 32.49 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.108 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.7 mtm -142.14 92.4 2.43 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -80.13 60.46 3.65 Favored 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 113.205 -1.816 . . . . 0.0 108.704 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -57.21 -27.97 62.46 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 113.916 -1.493 . . . . 0.0 112.638 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.0 m -49.74 136.28 17.83 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.462 1.101 . . . . 0.0 111.842 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -53.73 -43.78 69.34 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 114.115 -1.402 . . . . 0.0 112.26 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 m -114.8 39.7 2.79 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 114.039 -1.437 . . . . 0.0 111.309 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.9 45.48 1.6 Allowed Glycine 0 N--CA 1.506 3.334 0 CA-C-N 114.93 -1.032 . . . . 0.0 112.717 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.55 -11.63 59.88 Favored 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.055 -1.073 . . . . 0.0 113.488 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 t -28.58 133.04 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 116.042 1.868 . . . . 0.0 116.042 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.4 ttm105 -132.65 60.19 1.7 Allowed 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 113.139 -1.846 . . . . 0.0 106.793 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 87.8 p 42.7 39.63 1.72 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-N 112.705 -2.043 . . . . 0.0 112.546 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.08 -18.5 2.71 Favored Glycine 0 N--CA 1.493 2.453 0 CA-C-N 112.605 -2.089 . . . . 0.0 112.827 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -130.36 121.98 27.01 Favored 'General case' 0 N--CA 1.505 2.287 0 C-N-CA 119.483 -0.887 . . . . 0.0 109.28 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 30.7 m -74.28 76.33 1.84 Allowed 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 122.387 1.089 . . . . 0.0 111.117 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.325 0 O-C-N 119.027 -2.296 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.6 p . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -127.03 148.73 50.11 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -94.95 171.63 30.19 Favored Glycine 0 N--CA 1.494 2.507 0 CA-C-N 113.93 -1.486 . . . . 0.0 110.818 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -52.48 137.85 28.95 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-N 114.61 -0.795 . . . . 0.0 111.875 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.57 12.29 84.39 Favored Glycine 0 N--CA 1.492 2.407 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.665 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.18 167.15 11.54 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.366 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.422 ' HD3' ' HZ3' ' A' ' 24' ' ' LYS . 1.3 mppt? -76.47 86.63 3.2 Favored 'General case' 0 N--CA 1.499 1.993 0 CA-C-O 121.884 0.85 . . . . 0.0 110.167 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 7.1 p -86.2 -170.81 3.26 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 114.163 -1.38 . . . . 0.0 112.857 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -159.95 125.22 4.02 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.89 -1.504 . . . . 0.0 107.843 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.3 mtp85 -74.4 -7.8 54.13 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.024 -1.444 . . . . 0.0 110.881 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.5 tp -95.21 -22.42 17.83 Favored 'General case' 0 N--CA 1.489 1.525 0 CA-C-N 114.821 -1.081 . . . . 0.0 108.533 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' N ' ' A' ' 14' ' ' ASP . 69.5 mmm -144.36 42.37 1.39 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 123.863 0.727 . . . . 0.0 110.879 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -8.35 66.94 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 C-N-CA 125.977 1.711 . . . . 0.0 115.017 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.496 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.3 t70 -50.45 -32.05 16.86 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 110.779 -2.919 . . . . 0.0 112.455 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 6.9 m -62.84 143.21 57.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.84 1.338 . . . . 0.0 111.015 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -57.33 -46.4 83.3 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.235 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.8 m -103.91 32.44 3.93 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.192 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 33.85 43.58 0.3 Allowed Glycine 0 N--CA 1.507 3.427 0 CA-C-N 114.335 -1.302 . . . . 0.0 113.249 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.7 -13.06 59.74 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -21.1 125.56 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 117.349 2.352 . . . . 0.0 117.349 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -113.85 66.72 0.67 Allowed 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 113.265 -1.789 . . . . 0.0 107.008 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 4.2 t 50.38 29.45 3.87 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 113.281 -1.781 . . . . 0.0 113.037 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.5 -19.97 2.78 Favored Glycine 0 N--CA 1.497 2.701 0 CA-C-N 114.539 -1.209 . . . . 0.0 113.083 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HZ3' ' HD3' ' A' ' 7' ' ' LYS . 6.9 mmpt? -121.56 116.0 23.83 Favored 'General case' 0 N--CA 1.503 2.204 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.6 m -55.96 114.04 1.76 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-O 122.509 1.147 . . . . 0.0 113.343 -179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.39 0 O-C-N 119.589 -1.944 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.3 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.416 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 4.9 mptt -111.57 131.9 54.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 123.82 0.7 . . . . 0.0 111.405 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.02 175.31 54.6 Favored Glycine 0 N--CA 1.496 2.676 0 CA-C-N 114.608 -1.178 . . . . 0.0 111.041 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -58.05 142.79 45.68 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.082 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.0 12.09 64.55 Favored Glycine 0 N--CA 1.493 2.476 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.372 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.22 158.28 23.61 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 120.36 -0.536 . . . . 0.0 111.041 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 tptt -74.81 83.22 2.14 Favored 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.506 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.75 -164.73 0.83 Allowed 'General case' 0 N--CA 1.492 1.65 0 CA-C-N 114.174 -1.375 . . . . 0.0 112.602 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.07 127.85 4.67 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.092 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -15.83 62.94 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-N 113.497 -1.683 . . . . 0.0 112.208 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.6 -8.1 58.97 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.609 -0.836 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.528 ' O ' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -163.74 38.42 0.09 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -4.74 63.88 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.917 0 O-C-N 125.76 1.913 . . . . 0.0 114.177 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.528 ' N ' ' O ' ' A' ' 12' ' ' MET . 1.8 p30 -57.86 -17.59 17.29 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.279 -2.691 . . . . 0.0 115.054 -179.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 45.2 m -58.15 144.15 41.49 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 124.24 0.963 . . . . 0.0 110.751 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.1 m -53.51 -45.41 69.71 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 114.349 -1.296 . . . . 0.0 112.608 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 m -110.3 37.5 2.7 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 125.059 1.474 . . . . 0.0 110.723 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.73 39.84 1.97 Allowed Glycine 0 N--CA 1.503 3.134 0 CA-C-N 114.524 -1.216 . . . . 0.0 111.727 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.45 -13.75 59.37 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 113.671 -1.264 . . . . 0.0 112.858 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.469 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 17.8 t -35.4 120.62 0.56 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 124.899 1.374 . . . . 0.0 114.049 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -117.02 65.89 0.72 Allowed 'General case' 0 N--CA 1.487 1.41 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.145 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 35.0 m 48.78 31.21 2.98 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 112.792 -2.003 . . . . 0.0 112.835 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.83 -20.14 2.72 Favored Glycine 0 N--CA 1.496 2.647 0 CA-C-N 114.102 -1.408 . . . . 0.0 113.422 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -123.21 118.39 27.5 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 34.2 m -68.04 84.84 0.23 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 122.677 1.227 . . . . 0.0 111.807 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.382 0 O-C-N 118.69 -2.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.8 mttm -108.12 143.96 36.15 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-O 121.474 0.654 . . . . 0.0 112.247 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.76 -178.13 40.9 Favored Glycine 0 N--CA 1.496 2.681 0 CA-C-N 114.298 -1.319 . . . . 0.0 111.273 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -57.78 135.3 56.79 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 70.4 14.74 72.15 Favored Glycine 0 N--CA 1.495 2.591 0 CA-C-N 115.185 -0.916 . . . . 0.0 112.833 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.35 155.53 28.39 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.97 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -72.73 82.16 1.15 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.726 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.547 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.9 p -80.71 -163.46 0.58 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.631 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 140.71 11.74 Favored 'General case' 0 N--CA 1.499 2.022 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.34 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.5 mmt180 -66.56 -24.51 66.37 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.276 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.409 HD23 ' H ' ' A' ' 11' ' ' LEU . 0.5 OUTLIER -95.39 -12.2 26.4 Favored 'General case' 0 N--CA 1.495 1.823 0 CA-C-N 114.827 -1.078 . . . . 0.0 110.28 179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 66.8 mtm -142.61 90.85 2.26 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 124.393 1.058 . . . . 0.0 108.214 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' A' ' 20' ' ' CYS . 6.2 m-85 -80.01 62.54 4.24 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-N 113.627 -1.624 . . . . 0.0 107.406 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -59.01 -22.9 61.41 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.622 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.9 m -51.91 137.88 25.64 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 124.327 1.017 . . . . 0.0 110.717 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.8 m -53.47 -45.37 69.53 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.809 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.7 t -108.51 34.14 3.8 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-N 113.838 -1.528 . . . . 0.0 111.815 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.45 45.6 1.37 Allowed Glycine 0 N--CA 1.505 3.26 0 CA-C-N 114.294 -1.321 . . . . 0.0 112.438 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.47 -13.63 59.44 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 114.121 1.156 . . . . 0.0 114.121 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 13' ' ' TYR . 12.1 t -28.68 130.42 0.06 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -125.52 65.91 1.16 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.082 -1.821 . . . . 0.0 106.082 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.4 m 47.55 34.39 3.5 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 112.688 -2.051 . . . . 0.0 112.36 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.77 -21.37 2.69 Favored Glycine 0 N--CA 1.493 2.5 0 CA-C-N 113.75 -1.568 . . . . 0.0 113.16 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -123.31 120.15 32.22 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-N 118.111 0.955 . . . . 0.0 109.654 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 41.1 m -68.62 86.81 0.32 Allowed 'General case' 0 N--CA 1.495 1.79 0 CA-C-O 122.501 1.143 . . . . 0.0 111.714 -179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.386 0 O-C-N 119.071 -2.268 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.8 p . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mmtm -123.52 145.29 48.98 Favored 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 121.912 0.863 . . . . 0.0 112.654 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.56 166.48 53.4 Favored Glycine 0 N--CA 1.495 2.608 0 CA-C-N 113.52 -1.673 . . . . 0.0 111.457 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.08 127.21 30.68 Favored 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 115.135 -0.533 . . . . 0.0 111.884 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.97 8.37 69.27 Favored Glycine 0 N--CA 1.494 2.533 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.001 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.9 162.42 16.13 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.066 0.46 . . . . 0.0 110.697 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -63.87 90.79 0.06 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.427 -1.26 . . . . 0.0 110.333 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.514 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 1.5 p -88.9 -172.02 3.53 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.793 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.25 128.59 4.75 Favored 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 114.076 -1.42 . . . . 0.0 109.748 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.3 mtm180 -73.3 -12.65 60.92 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.874 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 pp -91.66 -12.19 34.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 124.038 0.836 . . . . 0.0 110.445 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.474 ' O ' ' N ' ' A' ' 14' ' ' ASP . 22.9 ptm -156.87 38.57 0.31 Allowed 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -5.35 64.39 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 126.23 1.812 . . . . 0.0 115.749 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 12' ' ' MET . 3.4 t0 -53.11 -31.97 44.9 Favored 'General case' 0 N--CA 1.494 1.741 0 CA-C-N 112.128 -2.305 . . . . 0.0 112.145 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 25.6 m -52.76 134.91 36.28 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 124.334 1.021 . . . . 0.0 112.149 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.5 m -55.87 -45.52 78.49 Favored 'General case' 0 N--CA 1.49 1.551 0 CA-C-N 114.206 -1.361 . . . . 0.0 112.28 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 m -108.01 36.47 2.77 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 124.784 1.303 . . . . 0.0 111.065 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 37.78 43.23 1.19 Allowed Glycine 0 N--CA 1.505 3.267 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.608 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.61 -14.41 58.83 Favored 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 113.866 1.062 . . . . 0.0 113.866 -179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.4 t -25.08 113.29 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.42 67.77 0.65 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 113.602 -1.636 . . . . 0.0 107.538 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 t 50.05 28.77 3.13 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 112.361 -2.199 . . . . 0.0 113.247 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.42 -16.87 2.9 Favored Glycine 0 N--CA 1.495 2.618 0 CA-C-N 114.453 -1.249 . . . . 0.0 113.457 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 mttm -128.92 116.0 18.71 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 90.6 m -58.09 86.09 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.294 0 O-C-N 118.628 -2.545 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.9 p . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -111.59 138.04 48.65 Favored 'General case' 0 N--CA 1.497 1.925 0 CA-C-O 121.479 0.657 . . . . 0.0 111.632 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.0 158.67 49.93 Favored Glycine 0 N--CA 1.494 2.555 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.955 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -63.89 110.91 2.26 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 114.919 -0.64 . . . . 0.0 110.784 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.63 16.6 9.23 Favored Glycine 0 N--CA 1.493 2.448 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.458 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -95.15 166.14 12.06 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 124.162 0.566 . . . . 0.0 110.604 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -75.22 83.99 2.4 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.016 -0.993 . . . . 0.0 109.799 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.423 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.22 -157.69 0.18 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.832 -179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.48 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -158.0 139.22 13.41 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.852 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 37.6 ptt180 -60.37 -32.25 71.12 Favored 'General case' 0 N--CA 1.5 2.025 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.478 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.71 8.0 45.26 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 114.348 -1.296 . . . . 0.0 111.407 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 7.4 ttp -150.19 95.23 2.25 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -83.05 56.94 3.68 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 113.664 -1.607 . . . . 0.0 107.027 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -24.63 60.98 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.828 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.9 m -54.8 141.26 33.52 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 124.454 1.096 . . . . 0.0 111.663 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.6 m -54.29 -45.32 72.49 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 113.937 -1.483 . . . . 0.0 112.351 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -108.27 37.5 2.47 Favored 'General case' 0 N--CA 1.499 2.001 0 CA-C-N 114.13 -1.396 . . . . 0.0 110.758 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 38.0 42.58 1.18 Allowed Glycine 0 N--CA 1.504 3.229 0 CA-C-N 114.482 -1.235 . . . . 0.0 112.544 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.48 -14.71 58.71 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.997 -1.102 . . . . 0.0 113.199 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.48 ' SG ' ' O ' ' A' ' 9' ' ' SER . 40.7 t -33.17 122.55 0.39 Allowed 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -117.27 66.1 0.73 Allowed 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 113.458 -1.701 . . . . 0.0 107.753 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 99.1 p 44.3 36.16 1.5 Allowed 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 112.793 -2.003 . . . . 0.0 112.9 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.85 -18.75 2.75 Favored Glycine 0 N--CA 1.496 2.644 0 CA-C-N 112.987 -1.915 . . . . 0.0 113.735 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 tttm -129.82 116.57 18.91 Favored 'General case' 0 N--CA 1.504 2.238 0 CA-C-N 117.762 0.781 . . . . 0.0 110.115 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.458 ' HB2' ' H ' ' A' ' 6' ' ' ALA . 56.5 m -65.28 90.65 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 122.87 1.319 . . . . 0.0 111.438 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.344 0 O-C-N 118.743 -2.473 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.022 0.439 . . . . 0.0 109.818 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 12.8 mttt -130.86 131.93 44.87 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.214 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.81 157.88 51.85 Favored Glycine 0 N--CA 1.495 2.605 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.729 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.97 93.76 0.2 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.894 0.854 . . . . 0.0 110.614 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 136.95 17.54 0.71 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 108.611 -1.796 . . . . 0.0 108.611 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.504 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -96.55 158.18 15.55 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 124.19 0.582 . . . . 0.0 110.892 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm -76.71 81.85 3.34 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.607 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.528 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 2.5 p -80.23 -157.96 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.889 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -160.06 152.88 21.41 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 41.6 mtp180 -57.21 -37.91 72.93 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.947 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tp -96.46 17.52 15.97 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.946 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 23.1 mtm -151.8 95.96 2.17 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 121.895 0.855 . . . . 0.0 110.157 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -89.14 51.42 2.14 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.71 -21.8 20.38 Favored 'General case' 0 N--CA 1.494 1.725 0 CA-C-N 112.009 -2.359 . . . . 0.0 113.538 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' N ' ' A' ' 20' ' ' CYS . 2.0 m -59.79 145.1 46.54 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 124.273 0.983 . . . . 0.0 110.455 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.6 m -52.54 -39.65 61.65 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -115.52 40.03 2.83 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.873 1.358 . . . . 0.0 113.773 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 42.95 43.11 5.3 Favored Glycine 0 N--CA 1.504 3.228 0 CA-C-O 122.32 0.955 . . . . 0.0 111.274 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.51 ' H ' ' HB2' ' A' ' 15' ' ' CYS . 0.3 OUTLIER -78.79 -12.87 60.04 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.584 -1.808 . . . . 0.0 112.843 -179.674 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' N ' ' SG ' ' A' ' 15' ' ' CYS . 46.7 t -45.18 127.91 7.17 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 124.529 1.143 . . . . 0.0 113.838 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -118.93 70.62 0.83 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 113.815 -1.539 . . . . 0.0 107.422 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 53.3 m 49.68 29.05 2.91 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 112.689 -2.05 . . . . 0.0 113.055 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.65 -16.63 2.86 Favored Glycine 0 N--CA 1.495 2.597 0 CA-C-N 114.461 -1.245 . . . . 0.0 113.647 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.53 115.49 20.28 Favored 'General case' 0 N--CA 1.503 2.195 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.342 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 33.7 m -69.89 135.91 50.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 118.583 -1.247 . . . . 0.0 108.594 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 119.628 -1.92 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.0 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.58 130.29 56.07 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 123.77 0.669 . . . . 0.0 111.977 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.31 -176.49 46.87 Favored Glycine 0 N--CA 1.497 2.752 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.071 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.16 138.45 49.9 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.14 15.05 49.47 Favored Glycine 0 N--CA 1.495 2.57 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.056 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.59 153.64 23.09 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.722 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -64.28 94.17 0.11 Allowed 'General case' 0 N--CA 1.494 1.762 0 CA-C-N 114.477 -1.238 . . . . 0.0 109.539 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.58 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 5.1 p -91.05 -170.04 2.54 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 113.892 -1.504 . . . . 0.0 112.731 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.13 125.03 3.88 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-N 113.919 -1.491 . . . . 0.0 107.828 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.401 ' NE ' ' H ' ' A' ' 22' ' ' SER . 96.8 mtt180 -75.42 -15.87 60.4 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 113.532 -1.667 . . . . 0.0 109.837 -179.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.417 ' N ' HD12 ' A' ' 11' ' ' LEU . 9.1 mp -75.95 -15.19 60.21 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 114.928 -1.033 . . . . 0.0 108.846 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' ASP . 7.5 ptp -164.52 50.89 0.12 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.071 0.857 . . . . 0.0 110.45 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -7.33 66.28 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.509 0 O-C-N 125.572 1.795 . . . . 0.0 114.947 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' MET . 0.5 OUTLIER -50.47 -28.58 8.59 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 110.829 -2.896 . . . . 0.0 113.025 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.444 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 55.5 m -60.7 140.06 57.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 124.772 1.295 . . . . 0.0 111.091 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.4 m -54.61 -45.49 73.69 Favored 'General case' 0 N--CA 1.491 1.591 0 CA-C-N 114.19 -1.368 . . . . 0.0 112.231 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 m -112.47 38.57 2.7 Favored 'General case' 0 N--CA 1.5 2.065 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.646 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.08 43.76 1.9 Allowed Glycine 0 N--CA 1.503 3.144 0 CA-C-N 114.531 -1.213 . . . . 0.0 112.817 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.68 -12.18 59.82 Favored 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 114.319 -0.941 . . . . 0.0 113.044 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -31.03 120.96 0.22 Allowed 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 115.914 1.82 . . . . 0.0 115.914 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -119.09 69.83 0.82 Allowed 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.401 ' H ' ' NE ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 52.47 24.39 2.99 Favored 'General case' 0 N--CA 1.499 1.982 0 CA-C-N 112.387 -2.188 . . . . 0.0 112.884 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.91 -12.9 2.88 Favored Glycine 0 N--CA 1.496 2.651 0 CA-C-O 118.681 -1.066 . . . . 0.0 113.065 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.8 mmtm -125.89 119.64 28.33 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 68.4 m -67.05 84.54 0.13 Allowed 'General case' 0 N--CA 1.494 1.771 0 CA-C-O 122.603 1.192 . . . . 0.0 113.414 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.407 0 O-C-N 119.039 -2.288 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 11.9 p . . . . . 0 N--CA 1.49 1.533 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -107.64 141.21 39.48 Favored 'General case' 0 N--CA 1.499 1.988 0 CA-C-O 121.439 0.637 . . . . 0.0 111.48 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.01 161.59 54.12 Favored Glycine 0 N--CA 1.497 2.757 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.684 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -70.69 111.83 6.46 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.323 0.582 . . . . 0.0 111.113 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.96 15.66 19.39 Favored Glycine 0 N--CA 1.494 2.511 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.791 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.35 163.88 13.06 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 124.343 0.672 . . . . 0.0 110.348 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 56.7 mttm -65.3 104.23 0.91 Allowed 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.0 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.428 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.4 p -102.26 -161.53 0.86 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.249 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.48 140.99 11.63 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 123.559 0.537 . . . . 0.0 109.675 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 mtm180 -63.87 -28.24 69.71 Favored 'General case' 0 N--CA 1.498 1.966 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.65 -8.44 34.78 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.877 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -144.42 91.35 2.18 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 124.04 0.838 . . . . 0.0 109.359 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -81.0 60.02 4.03 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 113.23 -1.805 . . . . 0.0 107.772 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.73 -23.66 60.19 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-N 114.424 -1.262 . . . . 0.0 112.661 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.4 m -47.71 135.27 11.94 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 124.565 1.165 . . . . 0.0 111.71 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 61.2 m -52.56 -41.89 63.95 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-N 114.099 -1.409 . . . . 0.0 111.908 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.6 m -111.24 36.8 3.06 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 125.04 1.462 . . . . 0.0 111.586 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 34.61 41.94 0.28 Allowed Glycine 0 N--CA 1.509 3.557 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.77 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.84 -12.52 59.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -26.87 121.32 0.09 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.9 ttp180 -119.59 65.31 0.8 Allowed 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 113.527 -1.669 . . . . 0.0 107.57 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 7.6 t 49.93 27.75 2.54 Favored 'General case' 0 N--CA 1.499 2.024 0 CA-C-N 112.761 -2.018 . . . . 0.0 113.414 179.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.59 -9.91 2.9 Favored Glycine 0 N--CA 1.496 2.64 0 CA-C-N 114.222 -1.354 . . . . 0.0 112.503 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.03 113.29 13.77 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 179.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 55.3 m -65.11 86.11 0.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-O 122.717 1.246 . . . . 0.0 112.048 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.346 0 O-C-N 118.762 -2.461 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.2 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -120.38 154.56 34.94 Favored 'General case' 0 N--CA 1.501 2.101 0 CA-C-O 121.76 0.791 . . . . 0.0 112.936 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.59 179.96 46.23 Favored Glycine 0 N--CA 1.497 2.74 0 CA-C-N 113.723 -1.581 . . . . 0.0 112.694 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -57.8 138.96 55.09 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 67.79 12.4 62.06 Favored Glycine 0 N--CA 1.495 2.585 0 CA-C-N 114.994 -1.003 . . . . 0.0 113.128 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.427 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -73.47 164.04 27.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.932 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 76.81 6.4 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.163 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -81.29 -157.79 0.19 Allowed 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.35 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.502 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 46.7 t -161.02 159.55 29.5 Favored 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 122.638 1.208 . . . . 0.0 110.211 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.11 -33.77 76.53 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-N 112.321 -2.218 . . . . 0.0 109.313 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -97.04 1.3 49.98 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 114.708 -1.133 . . . . 0.0 110.434 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 36.3 mtp -143.39 92.56 2.38 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.953 0.882 . . . . 0.0 111.138 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -86.78 55.65 3.66 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -13.88 61.95 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.326 -1.761 . . . . 0.0 115.027 -179.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.511 ' SG ' ' HB2' ' A' ' 20' ' ' CYS . 4.1 m -56.14 143.79 31.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 123.931 0.77 . . . . 0.0 110.342 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.3 m -56.4 -45.15 80.76 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-N 114.913 -1.039 . . . . 0.0 112.366 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.5 t -104.51 34.0 3.31 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 124.812 1.32 . . . . 0.0 111.522 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 40.2 41.43 2.11 Favored Glycine 0 N--CA 1.502 3.044 0 CA-C-N 114.236 -1.347 . . . . 0.0 112.066 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.54 -12.78 59.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 113.849 -1.175 . . . . 0.0 113.349 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.511 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 33.9 t -35.83 132.87 0.46 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.5 ttm-85 -129.95 62.44 1.56 Allowed 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 112.911 -1.95 . . . . 0.0 107.829 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.3 m 43.13 41.66 2.94 Favored 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.928 -1.942 . . . . 0.0 111.946 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.34 2.28 Favored Glycine 0 N--CA 1.493 2.442 0 CA-C-N 112.946 -1.934 . . . . 0.0 113.29 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -121.65 124.98 45.6 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.014 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.568 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 11.4 m -75.56 72.95 2.56 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.534 1.159 . . . . 0.0 111.418 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.365 0 O-C-N 118.523 -2.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.8 p . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.921 -0.399 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.5 mttm -110.17 123.59 50.02 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 123.563 0.539 . . . . 0.0 109.851 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -68.93 169.45 42.5 Favored Glycine 0 N--CA 1.499 2.875 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.385 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.48 105.26 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-O 121.375 0.607 . . . . 0.0 112.061 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 109.43 21.13 7.41 Favored Glycine 0 N--CA 1.494 2.541 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.075 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.442 ' H ' ' HB2' ' A' ' 25' ' ' CYS . . . -91.94 153.32 19.56 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 17.5 tptt -70.43 84.37 0.59 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 124.188 0.93 . . . . 0.0 108.678 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.494 ' HB3' ' SG ' ' A' ' 25' ' ' CYS . 1.0 OUTLIER -79.79 -159.78 0.23 Allowed 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.121 -1.399 . . . . 0.0 110.738 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.23 142.2 12.85 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.309 0.576 . . . . 0.0 110.109 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.2 ptt85 -62.89 -29.95 71.16 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.253 -1.339 . . . . 0.0 109.564 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.58 -1.85 42.97 Favored 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.738 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.0 mmm -147.8 92.77 2.11 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 124.1 0.875 . . . . 0.0 108.831 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -81.99 60.82 5.0 Favored 'General case' 0 N--CA 1.499 1.98 0 CA-C-N 113.607 -1.633 . . . . 0.0 107.637 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -13.59 33.5 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 114.231 -1.35 . . . . 0.0 113.218 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.2 m -56.74 142.13 41.51 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.908 0.755 . . . . 0.0 111.496 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.1 m -51.44 -43.29 62.01 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.742 -1.572 . . . . 0.0 112.46 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.6 m -118.22 36.46 4.35 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 39.73 46.4 2.96 Favored Glycine 0 N--CA 1.503 3.117 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.317 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.29 -14.28 59.12 Favored 'General case' 0 N--CA 1.496 1.868 0 CA-C-N 114.213 -0.993 . . . . 0.0 113.091 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.9 t -28.25 120.58 0.12 Allowed 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 115.971 1.841 . . . . 0.0 115.971 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -116.35 67.66 0.72 Allowed 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.291 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.4 m 49.81 28.88 2.95 Favored 'General case' 0 N--CA 1.502 2.126 0 CA-C-N 112.958 -1.928 . . . . 0.0 113.125 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 140.75 -14.23 2.9 Favored Glycine 0 N--CA 1.495 2.614 0 CA-C-N 114.463 -1.244 . . . . 0.0 112.974 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -129.03 112.33 13.91 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 56.8 m -61.73 95.09 0.05 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 122.676 1.227 . . . . 0.0 111.662 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.396 0 O-C-N 118.861 -2.399 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_