data_1dw4_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 1dw4 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.1 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.324 0.583 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.7 mmmm -122.34 168.24 12.31 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.343 -0.848 . . . . 0.0 110.344 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.24 151.42 17.18 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -46.18 153.05 0.35 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.156 -1.203 . . . . 0.0 110.252 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.88 -18.74 5.74 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.502 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -78.23 46.45 0.61 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.761 -1.435 . . . . 0.0 110.703 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.593 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 52.53 164.15 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.221 -0.924 . . . . 0.0 110.824 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 5.0 p -161.17 170.53 20.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.527 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 6.7 t -98.71 -86.86 0.35 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.254 -0.904 . . . . 0.0 108.967 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' A' ' 9' ' ' SER . 13.1 mmm180 -156.72 -38.89 0.08 Allowed 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.15 42.14 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.288 -0.883 . . . . 0.0 109.325 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.527 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 79.9 mtp -83.38 -15.37 50.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.295 -0.878 . . . . 0.0 109.529 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 12' ' ' MET . 12.9 m-85 74.9 49.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.446 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -99.32 -38.93 8.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.304 -0.873 . . . . 0.0 109.163 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 8.1 m -54.96 122.84 11.77 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 122.381 1.086 . . . . 0.0 109.658 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -63.12 -37.95 89.25 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.661 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.46 ' O ' ' O ' ' A' ' 18' ' ' GLY . 41.7 p -104.53 -99.69 0.32 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.299 -0.876 . . . . 0.0 109.465 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.46 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -60.93 -143.25 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.5 t -148.07 -162.88 1.64 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.25 -1.147 . . . . 0.0 109.532 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -46.74 132.2 11.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 110.225 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -146.18 128.86 16.18 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.41 -0.806 . . . . 0.0 109.141 179.09 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ARG . 46.7 t 44.15 25.97 0.13 Allowed 'General case' 0 C--N 1.296 -1.734 0 O-C-N 121.463 -0.773 . . . . 0.0 109.863 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.463 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 96.36 -26.44 21.44 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.593 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.5 mptp? -103.26 165.4 11.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.312 -1.111 . . . . 0.0 109.321 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.441 0 O-C-N 121.169 -0.957 . . . . 0.0 109.908 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.5 p . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.679 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.6 mmmt -109.13 -141.34 0.38 Allowed 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.3 -0.875 . . . . 0.0 109.678 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.473 ' O ' ' HB3' ' A' ' 25' ' ' CYS . . . -178.87 163.0 30.42 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.441 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -47.84 149.07 1.39 Allowed 'General case' 0 C--N 1.307 -1.269 0 O-C-N 120.896 -1.356 . . . . 0.0 109.275 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.74 -39.99 3.1 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 108.454 -1.859 . . . . 0.0 108.454 -179.148 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -67.32 71.41 0.11 Allowed 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.425 -1.044 . . . . 0.0 108.495 179.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.92 153.13 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.763 0.792 . . . . 0.0 110.697 -179.211 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -131.94 -174.81 3.53 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -179.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 4.0 m -90.33 -46.84 8.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.659 -1.276 . . . . 0.0 108.701 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 9' ' ' SER . 1.9 mmm180 179.2 -87.55 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.614 -0.678 . . . . 0.0 109.746 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.95 21.32 7.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.046 -1.034 . . . . 0.0 109.827 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.46 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -56.35 -25.3 48.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.244 -0.91 . . . . 0.0 109.184 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 48.07 64.9 1.46 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.359 -0.838 . . . . 0.0 109.788 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.46 ' OD1' ' O ' ' A' ' 12' ' ' MET . 1.1 m-20 -119.82 -24.77 6.05 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.18 -0.95 . . . . 0.0 109.541 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 4.1 m -53.45 120.79 6.54 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.42 1.105 . . . . 0.0 109.443 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -47.03 -35.14 6.42 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.694 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 38.7 p -85.89 -137.07 0.07 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -52.99 -105.06 0.01 OUTLIER Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.1 p -151.08 -158.26 0.9 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.038 -1.272 . . . . 0.0 109.785 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 7.2 m -68.03 137.27 54.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.368 -0.833 . . . . 0.0 109.698 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.464 ' O ' ' OG ' ' A' ' 22' ' ' SER . 12.9 ttp180 -125.92 125.08 42.18 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.232 -0.918 . . . . 0.0 109.091 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.464 ' OG ' ' O ' ' A' ' 21' ' ' ARG . 79.8 p 50.52 22.42 1.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.384 -0.823 . . . . 0.0 109.335 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.98 -19.76 53.0 Favored Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -100.47 140.96 33.98 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.378 -1.072 . . . . 0.0 109.409 179.881 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.02 -1.05 . . . . 0.0 108.916 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.253 0.549 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 20.6 mmtm -112.98 165.06 12.7 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.236 -0.915 . . . . 0.0 110.314 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.56 163.33 19.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -52.02 155.43 1.86 Allowed 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.175 -1.191 . . . . 0.0 110.152 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.416 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 59.62 8.24 7.13 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 18.34 0.88 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.852 -1.381 . . . . 0.0 110.587 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.04 154.13 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.189 -0.944 . . . . 0.0 110.713 -179.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -157.06 178.8 9.94 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.775 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 8.9 t -91.74 -45.43 8.43 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.831 -1.168 . . . . 0.0 108.646 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.434 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 176.91 -83.42 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.866 0 O-C-N 121.753 -0.592 . . . . 0.0 109.771 179.126 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.99 24.17 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.272 -0.893 . . . . 0.0 109.756 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 74.5 mmm -61.33 -16.53 46.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.051 -1.031 . . . . 0.0 109.256 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 58.25 60.96 2.45 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 0.0 109.572 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -106.81 -26.05 11.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.406 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -55.41 122.18 10.62 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 122.349 1.071 . . . . 0.0 109.562 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -53.68 -43.15 68.64 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.846 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.449 ' CG2' ' O ' ' A' ' 17' ' ' THR . 6.7 t -139.86 88.08 2.21 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 109.521 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.67 -162.53 26.61 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.3 p -132.7 -165.51 1.61 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.257 -1.143 . . . . 0.0 109.371 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 23.5 m -92.03 136.51 33.11 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.186 -0.946 . . . . 0.0 109.697 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -125.38 106.94 10.2 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.19 -0.944 . . . . 0.0 108.813 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.74 12.38 7.59 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 121.592 -0.693 . . . . 0.0 109.336 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 7' ' ' LYS . . . 112.26 -16.5 24.72 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.9 mtpt -94.19 145.8 24.45 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.615 -0.932 . . . . 0.0 109.356 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.489 0 O-C-N 121.113 -0.992 . . . . 0.0 109.454 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.421 0.629 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.457 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 10.1 mptt -97.67 167.42 10.97 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.329 -0.857 . . . . 0.0 109.785 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.19 170.69 17.13 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.341 -1.904 . . . . 0.0 108.341 179.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.428 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -49.38 147.27 3.34 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.738 -1.448 . . . . 0.0 108.896 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.23 -31.7 6.17 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.03 75.48 0.93 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.587 -0.949 . . . . 0.0 108.465 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.77 152.46 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.219 0.533 . . . . 0.0 110.58 -179.448 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.603 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.3 -177.6 4.79 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.603 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m -91.24 -62.5 1.43 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.791 -1.193 . . . . 0.0 109.074 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.497 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 166.01 102.4 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.497 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.18 15.64 1.37 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.599 -0.688 . . . . 0.0 109.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.44 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 3.9 mmm -69.71 -18.99 63.57 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.281 -0.887 . . . . 0.0 109.367 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 12' ' ' MET . 43.8 m-85 60.53 66.96 0.87 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.318 -0.864 . . . . 0.0 109.169 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -123.3 -22.44 5.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.356 -0.84 . . . . 0.0 109.767 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -64.27 119.93 11.22 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 122.483 1.135 . . . . 0.0 110.315 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.87 -38.37 55.79 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.42 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.48 102.71 4.53 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.389 -0.819 . . . . 0.0 109.397 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.99 -166.68 12.77 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.3 p -128.85 173.18 10.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.129 -1.219 . . . . 0.0 109.435 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.5 m -60.64 102.68 0.2 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.274 -0.891 . . . . 0.0 109.492 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.545 ' N ' ' O ' ' A' ' 24' ' ' LYS . 34.4 ttp180 -99.9 139.88 34.93 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.155 -0.965 . . . . 0.0 109.118 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 18.75 6.23 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.081 -1.012 . . . . 0.0 109.353 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.38 -11.9 70.81 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.9 mtpp -119.71 170.04 9.56 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.084 -1.245 . . . . 0.0 109.569 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m . . . . . 0 C--N 1.301 -1.503 0 O-C-N 121.187 -0.946 . . . . 0.0 109.472 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.7 p . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.402 0.62 . . . . 0.0 109.598 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 6.5 mmtp -119.33 -179.98 4.02 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.495 -0.753 . . . . 0.0 110.108 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -123.74 163.49 17.31 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -44.81 158.88 0.05 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.216 -1.167 . . . . 0.0 109.308 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 90.08 -34.57 4.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 108.869 -1.692 . . . . 0.0 108.869 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.467 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.5 72.57 0.99 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.381 -1.07 . . . . 0.0 108.449 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.654 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -35.52 156.18 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.179 0.514 . . . . 0.0 110.406 -179.159 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.26 -177.32 4.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.025 -1.047 . . . . 0.0 108.448 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.3 -62.51 1.42 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.898 -1.126 . . . . 0.0 109.256 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.52 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 167.9 96.94 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 O-C-N 121.564 -0.71 . . . . 0.0 109.923 179.418 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.84 54.56 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.579 -0.701 . . . . 0.0 109.547 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.413 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -108.31 -18.8 13.67 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' MET . 88.9 m-85 60.46 80.94 0.19 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 3.6 m-20 -144.93 -37.8 0.28 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.248 -0.908 . . . . 0.0 109.347 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -60.37 126.13 26.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.42 1.105 . . . . 0.0 108.661 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.559 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -59.43 -36.51 76.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 46.5 p -108.1 135.91 48.66 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.057 -1.027 . . . . 0.0 109.513 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 51.12 -150.4 6.61 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.63 -164.13 1.45 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.393 -1.063 . . . . 0.0 109.469 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -61.28 107.72 0.81 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.465 -0.772 . . . . 0.0 109.854 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -97.17 137.99 35.36 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.004 -1.06 . . . . 0.0 109.05 179.313 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.6 20.77 1.14 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.363 -0.836 . . . . 0.0 109.275 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.7 -16.73 60.1 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.654 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 61.2 mttt -106.06 174.08 6.04 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.11 -1.229 . . . . 0.0 110.157 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 O-C-N 120.92 -1.112 . . . . 0.0 108.819 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.0 mmtt -134.04 168.48 18.73 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.123 -0.986 . . . . 0.0 110.377 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.453 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -100.79 170.05 21.63 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.431 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -60.8 159.81 10.5 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.157 -1.202 . . . . 0.0 109.918 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 60.22 8.39 8.77 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.502 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.37 15.96 1.45 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.914 -1.345 . . . . 0.0 110.412 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.89 153.85 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.862 0.839 . . . . 0.0 110.675 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.609 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -159.64 -177.94 6.74 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.41 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.609 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.2 -56.0 3.39 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 120.875 -1.141 . . . . 0.0 108.563 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CB ' ' O ' ' A' ' 9' ' ' SER . 1.1 ptm180 159.33 101.15 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 121.306 0.574 . . . . 0.0 109.655 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.55 51.96 0.46 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.679 -0.638 . . . . 0.0 109.799 179.668 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.49 ' CB ' ' OD2' ' A' ' 14' ' ' ASP . 1.9 mtp -106.28 -7.56 17.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.373 -0.83 . . . . 0.0 109.275 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 54.19 51.6 14.16 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.457 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.49 ' OD2' ' CB ' ' A' ' 12' ' ' MET . 9.3 m-20 -104.62 -14.46 15.61 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.478 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.9 m -67.18 124.53 23.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 122.496 1.141 . . . . 0.0 109.706 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -59.84 -9.91 3.39 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.489 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.3 p -133.14 1.6 3.53 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.713 -1.242 . . . . 0.0 111.093 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -178.1 -145.2 5.86 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.159 -1.496 . . . . 0.0 110.41 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -119.74 -171.02 2.05 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.392 -1.064 . . . . 0.0 109.326 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -70.29 142.14 52.29 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 110.172 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.462 ' O ' ' OG ' ' A' ' 22' ' ' SER . 0.2 OUTLIER -125.24 125.39 43.51 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.655 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 21' ' ' ARG . 31.0 p 54.94 17.94 2.03 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.553 -0.717 . . . . 0.0 109.465 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.94 -45.71 1.28 Allowed Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.902 -1.279 . . . . 0.0 109.902 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.5 mttt -93.52 162.14 14.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.281 -1.129 . . . . 0.0 109.758 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.641 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 3.9 mmtm -127.29 174.73 8.72 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -120.04 168.49 13.74 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.454 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -48.49 154.45 0.64 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.882 -1.364 . . . . 0.0 109.515 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.78 -40.04 2.84 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.536 -2.226 . . . . 0.0 107.536 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.19 78.61 0.97 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.715 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -35.86 157.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.767 0.794 . . . . 0.0 110.676 -178.671 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -132.73 -177.55 4.54 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -179.31 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.595 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.42 -45.75 8.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.708 -1.245 . . . . 0.0 109.261 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 31.1 ttt180 -175.08 -85.22 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.477 -0.764 . . . . 0.0 109.899 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.68 33.81 5.32 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.003 -1.061 . . . . 0.0 109.854 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.473 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.2 mtt -67.8 -8.82 39.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.223 -0.923 . . . . 0.0 109.152 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.473 ' HB2' ' O ' ' A' ' 12' ' ' MET . 23.7 m-85 62.38 58.68 1.68 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.11 -41.21 5.89 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.216 -0.928 . . . . 0.0 109.315 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -55.3 123.77 14.89 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.439 1.114 . . . . 0.0 109.017 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.97 -28.79 54.24 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.065 -179.721 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 p -139.22 158.95 43.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.191 -0.943 . . . . 0.0 109.545 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 61.39 -146.81 48.11 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.4 p -150.85 171.12 17.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.253 -1.145 . . . . 0.0 109.602 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 20.9 m -56.5 114.9 2.22 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.377 -0.827 . . . . 0.0 109.553 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.0 mtt180 -119.03 141.82 48.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.124 -0.985 . . . . 0.0 109.247 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 11.2 t 51.4 21.98 1.34 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.166 -0.958 . . . . 0.0 109.068 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.63 -10.77 58.65 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.715 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.1 mttp -106.66 152.57 23.59 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.13 -1.217 . . . . 0.0 109.665 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.454 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--N 1.301 -1.542 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.596 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.284 0.564 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.4 mmtp -119.07 169.89 9.53 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.178 -0.951 . . . . 0.0 110.041 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.457 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -112.48 177.47 18.48 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.873 -1.691 . . . . 0.0 108.873 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.455 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.6 pttt -59.53 153.63 19.2 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 120.89 -1.359 . . . . 0.0 109.447 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.66 -32.47 4.51 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.54 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -67.19 67.44 0.07 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.351 -1.087 . . . . 0.0 109.356 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -20.8 136.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.768 0.794 . . . . 0.0 111.831 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.2 -178.28 3.63 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.789 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.71 31.55 1.19 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 0.0 109.79 -178.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.7 ttm180 81.19 -43.59 0.19 Allowed 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.981 -0.449 . . . . 0.0 110.262 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.411 HD11 ' HG2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -149.95 81.61 1.38 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.819 -1.176 . . . . 0.0 110.72 -179.47 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.445 ' HG3' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -128.78 -9.19 4.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.101 -1.0 . . . . 0.0 109.613 178.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 58.22 59.55 3.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.036 -1.04 . . . . 0.0 109.85 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.01 -25.64 7.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.921 . . . . 0.0 109.181 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.4 m -56.75 123.75 16.05 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.393 1.092 . . . . 0.0 109.706 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.01 -19.89 34.58 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.236 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.4 p -93.52 -133.47 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.49 -0.756 . . . . 0.0 109.262 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.92 -95.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -147.54 -171.61 3.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.229 -1.16 . . . . 0.0 109.594 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.9 m -62.56 142.58 57.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.71 134.5 45.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.165 -0.959 . . . . 0.0 108.982 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.6 p 47.93 22.72 0.4 Allowed 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.504 -0.748 . . . . 0.0 109.415 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.25 -32.25 6.62 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.764 -1.334 . . . . 0.0 109.764 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.4 mttt -93.67 148.5 22.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.244 -1.151 . . . . 0.0 109.743 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.455 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.087 -1.008 . . . . 0.0 109.138 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -110.19 165.01 12.09 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.238 -0.914 . . . . 0.0 110.233 -179.643 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.45 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -105.49 164.96 14.02 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -51.53 151.43 3.16 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.073 -1.251 . . . . 0.0 110.012 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.89 4.76 22.14 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.89 17.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.957 -1.32 . . . . 0.0 110.618 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.44 149.06 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.191 -0.943 . . . . 0.0 111.15 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -155.98 176.5 12.56 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.791 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.17 -53.7 4.13 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.033 -1.042 . . . . 0.0 108.712 179.365 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.516 ' CB ' ' O ' ' A' ' 9' ' ' SER . 7.6 ptt180 161.14 94.08 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 66.63 55.15 0.8 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.55 -0.719 . . . . 0.0 109.327 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.455 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -99.14 -9.48 23.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.438 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.455 ' HB2' ' O ' ' A' ' 12' ' ' MET . 14.2 m-85 69.02 31.56 4.08 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.17 -0.956 . . . . 0.0 109.607 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -97.9 -35.89 10.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.356 -0.84 . . . . 0.0 108.949 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -54.89 123.49 13.61 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 122.475 1.131 . . . . 0.0 109.989 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -62.61 -13.15 28.23 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.524 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.431 ' O ' ' C ' ' A' ' 18' ' ' GLY . 13.3 t -144.85 155.02 43.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 109.912 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.431 ' C ' ' O ' ' A' ' 17' ' ' THR . . . 42.11 -145.96 0.72 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.7 p -133.15 -166.53 1.78 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -1.101 . . . . 0.0 109.375 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.3 m -70.91 129.42 39.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.218 -0.926 . . . . 0.0 109.544 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -114.17 125.17 53.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.284 -0.885 . . . . 0.0 109.182 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.77 15.54 2.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.349 -0.844 . . . . 0.0 109.848 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.06 -34.78 5.23 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -93.68 165.84 12.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -1.188 . . . . 0.0 109.622 -179.681 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.487 1.401 0 O-C-N 121.151 -0.968 . . . . 0.0 109.649 -179.853 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.44 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 7.9 p . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.537 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -146.62 167.29 24.13 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.263 -0.898 . . . . 0.0 110.485 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.21 -172.15 28.54 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 108.599 -1.8 . . . . 0.0 108.599 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.1 160.07 6.63 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.858 -1.377 . . . . 0.0 109.312 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.41 -13.99 48.3 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.564 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -73.26 60.83 0.61 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -1.09 . . . . 0.0 108.989 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.564 ' C ' ' O ' ' A' ' 6' ' ' ALA . 11.4 mtmt -18.36 131.67 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.836 0.827 . . . . 0.0 111.803 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.579 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.85 -179.2 3.94 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -179.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.579 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.4 -58.52 2.41 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.875 -1.141 . . . . 0.0 108.778 179.562 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.558 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 10.2 ptm180 177.05 24.91 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.77 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.558 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 160.98 -18.35 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.05 -1.031 . . . . 0.0 110.624 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.464 ' C ' ' O ' ' A' ' 11' ' ' LEU . 1.1 mmt -39.03 -29.87 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.434 -0.791 . . . . 0.0 109.748 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.479 ' N ' ' O ' ' A' ' 11' ' ' LEU . 3.3 m-85 64.41 62.49 0.81 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.376 -0.828 . . . . 0.0 110.34 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -99.38 -15.16 18.87 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.089 -1.007 . . . . 0.0 108.992 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.8 m -64.7 125.04 23.51 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 122.252 1.025 . . . . 0.0 108.798 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -50.7 -52.73 37.38 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.195 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 t -135.61 59.31 1.72 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.001 -1.062 . . . . 0.0 109.642 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.67 -173.11 41.1 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.5 m -125.52 -169.13 1.94 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -1.185 . . . . 0.0 109.556 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.2 m -86.79 111.23 20.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.622 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -114.59 129.37 56.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.143 -0.973 . . . . 0.0 109.119 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.69 9.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.083 -1.01 . . . . 0.0 109.103 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.92 -9.22 69.82 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mttt -109.81 146.24 35.37 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.366 -1.079 . . . . 0.0 109.697 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.302 -1.496 0 O-C-N 121.253 -0.904 . . . . 0.0 109.145 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.7 p . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.141 0.496 . . . . 0.0 109.662 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.476 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 12.0 mmtm -116.08 163.07 16.48 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.328 -0.858 . . . . 0.0 110.187 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.26 167.06 22.35 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.476 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -61.05 159.54 11.49 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.134 -1.215 . . . . 0.0 110.172 -179.436 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.3 -0.64 15.92 Favored Glycine 0 N--CA 1.494 2.519 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.91 18.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.837 -1.39 . . . . 0.0 111.024 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.27 146.92 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.015 0.912 . . . . 0.0 111.076 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.566 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.6 p 172.48 178.11 0.08 Allowed 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.909 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.506 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 40.4 t -93.6 151.55 19.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.195 -0.941 . . . . 0.0 109.201 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 9' ' ' SER . 6.0 mtm180 -39.64 -37.88 0.56 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.47 ' O ' ' C ' ' A' ' 12' ' ' MET . 2.6 mp -85.88 -111.34 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.47 ' C ' ' O ' ' A' ' 11' ' ' LEU . 33.3 mtt 39.5 75.33 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.191 -0.943 . . . . 0.0 109.636 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -72.56 50.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.164 -0.96 . . . . 0.0 109.711 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.4 ' O ' ' C ' ' A' ' 15' ' ' CYS . 72.1 m-20 -95.02 -29.75 14.45 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.453 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 40.1 m -44.42 126.19 5.16 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 122.217 1.008 . . . . 0.0 109.667 179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -64.91 -6.17 7.76 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.666 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 p -138.65 25.54 2.59 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.762 -1.211 . . . . 0.0 110.742 -179.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.453 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . 145.45 -122.61 1.73 Allowed Glycine 0 N--CA 1.492 2.423 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.09 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 14.3 t -147.37 -163.71 1.83 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.335 -1.097 . . . . 0.0 109.321 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.534 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -78.29 132.85 37.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.18 -0.95 . . . . 0.0 111.381 -179.767 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.538 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.1 ttm180 -119.29 114.37 22.28 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 2.0 t 79.52 -23.7 0.23 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.705 -0.622 . . . . 0.0 110.365 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.439 ' C ' ' SG ' ' A' ' 20' ' ' CYS . . . 150.22 -14.29 0.97 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 110.037 -1.225 . . . . 0.0 110.037 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 45.9 mttt -128.46 156.64 42.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.905 -1.35 . . . . 0.0 110.494 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.566 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m . . . . . 0 N--CA 1.49 1.55 0 C-N-CA 120.064 -0.654 . . . . 0.0 109.817 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 37.6 mmtt -125.18 172.5 9.47 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.208 -0.932 . . . . 0.0 110.402 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.91 172.74 14.37 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.1 pttm -58.78 155.62 12.59 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 120.885 -1.362 . . . . 0.0 109.516 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.51 -30.67 7.08 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.495 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.11 75.46 3.68 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.653 -0.91 . . . . 0.0 108.699 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.67 150.23 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.528 0.68 . . . . 0.0 110.48 -179.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -128.66 -178.15 4.48 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.368 -0.832 . . . . 0.0 109.124 -179.531 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.527 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.0 35.39 0.98 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.218 -0.926 . . . . 0.0 109.848 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 55.33 93.17 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.151 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.273 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.31 62.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.516 0.674 . . . . 0.0 109.717 -179.609 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.473 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 2.6 mtp -117.9 -21.16 8.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.351 -0.843 . . . . 0.0 108.971 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.432 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.4 m-30 60.73 48.04 7.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 109.645 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.473 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 30.9 m-20 -111.46 -31.18 7.11 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.232 -0.917 . . . . 0.0 109.51 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.0 m -50.72 122.39 7.22 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 122.311 1.053 . . . . 0.0 108.923 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.55 -26.89 9.41 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.356 -179.463 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -132.52 113.24 12.86 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.232 -0.918 . . . . 0.0 109.805 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 -140.13 17.2 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.6 p -140.92 -169.46 2.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -1.108 . . . . 0.0 109.248 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 m -60.43 153.43 23.06 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.167 -0.958 . . . . 0.0 109.358 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -122.72 108.74 13.4 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.358 -0.839 . . . . 0.0 109.161 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 44.46 26.08 0.16 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.694 -0.629 . . . . 0.0 109.395 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.436 ' HA3' ' NH2' ' A' ' 10' ' ' ARG . . . 111.5 -27.69 10.33 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.89 -1.284 . . . . 0.0 109.89 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.0 mttt -102.79 135.15 44.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.208 -1.172 . . . . 0.0 109.837 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.461 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.211 -0.93 . . . . 0.0 108.777 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 121.241 0.543 . . . . 0.0 109.555 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 3.5 mmmt -113.57 169.75 8.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.312 -0.868 . . . . 0.0 109.744 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -106.79 172.35 18.15 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.538 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.0 OUTLIER -62.09 147.51 47.18 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.149 -1.207 . . . . 0.0 108.775 179.57 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.538 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 63.73 6.36 16.89 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.54 19.26 0.64 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.004 -1.291 . . . . 0.0 110.816 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.55 149.46 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.167 -0.958 . . . . 0.0 111.427 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.612 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -152.64 -178.05 6.62 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.612 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.14 -69.36 0.73 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 120.699 -1.251 . . . . 0.0 108.279 179.322 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.505 ' HB3' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 166.19 108.32 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.68 44.95 0.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.515 -0.741 . . . . 0.0 109.58 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.442 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 23.3 mmt -109.95 -23.3 11.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.314 -0.866 . . . . 0.0 109.236 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 62.74 52.34 2.81 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.367 -0.833 . . . . 0.0 109.796 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -101.99 -21.15 14.55 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.241 -0.912 . . . . 0.0 109.086 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.1 m -63.14 123.06 17.66 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 122.589 1.185 . . . . 0.0 109.811 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.04 -22.01 2.13 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.281 179.547 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.44 144.7 34.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.49 -0.756 . . . . 0.0 109.324 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.33 -146.93 45.68 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.5 m -144.46 -163.92 1.79 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.128 -1.219 . . . . 0.0 109.67 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 m -74.88 153.29 38.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.16 -0.962 . . . . 0.0 109.774 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 24' ' ' LYS . 5.1 ttt180 -145.77 116.08 7.51 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.434 ' HB2' ' CE ' ' A' ' 24' ' ' LYS . 34.8 m 61.42 15.54 6.7 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.457 -0.777 . . . . 0.0 109.565 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 103.01 -6.24 51.13 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.6 OUTLIER -110.7 161.67 15.52 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.284 -1.127 . . . . 0.0 109.64 -179.869 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.212 -0.93 . . . . 0.0 109.619 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.1 p . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.335 0.588 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 25.4 mmtp -111.77 168.29 9.69 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.495 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -114.29 167.83 12.42 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.474 ' HE3' HG22 ' A' ' 17' ' ' THR . 0.8 OUTLIER -46.91 165.44 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.306 -1.114 . . . . 0.0 110.074 -179.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.506 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 54.52 18.27 10.12 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.14 -1.584 . . . . 0.0 109.14 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -78.64 15.86 0.96 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.33 -1.1 . . . . 0.0 111.327 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.512 ' C ' ' O ' ' A' ' 6' ' ' ALA . 7.4 ptmm? 31.66 44.66 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 122.018 0.913 . . . . 0.0 109.68 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.597 ' N ' ' O ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -49.21 178.31 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 -178.917 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.555 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.25 36.4 0.99 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.042 -1.036 . . . . 0.0 109.57 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.52 ' CG ' HD22 ' A' ' 11' ' ' LEU . 2.0 ttp180 79.02 -80.94 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.978 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.52 HD22 ' CG ' ' A' ' 10' ' ' ARG . 2.0 mm? -115.53 79.62 1.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.001 -1.062 . . . . 0.0 109.487 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.449 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 2.8 mtt -122.53 -9.26 8.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 109.487 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 58.48 59.77 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.248 -0.907 . . . . 0.0 109.684 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -122.12 -21.21 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.679 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 19' ' ' SER . 57.5 m -58.32 119.63 7.27 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 122.483 1.135 . . . . 0.0 110.167 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.35 -18.4 4.05 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.707 179.402 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.474 HG22 ' HE3' ' A' ' 4' ' ' LYS . 2.4 t -114.98 -121.28 0.3 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.942 . . . . 0.0 109.833 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -61.2 -131.37 0.01 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.446 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.8 t -115.05 -149.36 0.44 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -1.182 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 25.9 m -96.7 137.19 36.15 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 109.803 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' A' ' 24' ' ' LYS . 1.4 ttp180 -107.08 117.02 32.97 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 50.11 23.04 1.04 Allowed 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.324 -0.86 . . . . 0.0 108.993 -179.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.597 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.76 -28.63 14.58 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.339 -1.505 . . . . 0.0 109.339 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 4.0 mttm -92.34 134.25 35.09 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.9 -1.353 . . . . 0.0 109.0 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 1.7 m . . . . . 0 C--N 1.291 -1.946 0 O-C-N 121.736 -0.603 . . . . 0.0 109.687 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.357 0.599 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.7 mmtt -126.9 172.93 10.0 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.261 -0.899 . . . . 0.0 110.443 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -113.78 -175.5 19.05 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 108.712 -1.755 . . . . 0.0 108.712 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.535 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.3 OUTLIER -62.59 145.18 55.08 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.775 -1.426 . . . . 0.0 108.108 179.411 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.535 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 106.22 -32.26 7.52 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 108.147 -1.981 . . . . 0.0 108.147 -178.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -72.24 76.14 0.99 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.5 153.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.463 0.649 . . . . 0.0 110.691 -179.263 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.578 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -137.14 -175.12 3.94 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.578 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.2 t -90.28 -44.11 9.93 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.457 -1.402 . . . . 0.0 109.771 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 9' ' ' SER . 3.0 ptm180 175.97 -34.76 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.82 0 O-C-N 121.332 -0.855 . . . . 0.0 109.981 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.81 23.4 0.77 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.2 mmt -60.27 -16.05 30.58 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.121 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 50.21 47.36 23.77 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.273 -0.892 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -94.67 -19.62 20.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 109.004 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 2.8 m -63.88 124.63 22.02 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.376 1.084 . . . . 0.0 108.522 179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -50.65 -52.27 41.3 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.829 -179.21 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.7 p -115.97 -61.81 1.68 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.091 -1.006 . . . . 0.0 110.216 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.527 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -62.37 -162.44 0.27 Allowed Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.95 173.66 11.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.395 -1.062 . . . . 0.0 108.863 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 m -58.62 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.04 -1.037 . . . . 0.0 109.363 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 24' ' ' LYS . 12.0 ttm180 -96.95 122.06 39.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.098 -1.001 . . . . 0.0 109.404 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 t 58.6 30.69 20.19 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.416 -0.803 . . . . 0.0 109.485 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.16 -10.5 63.24 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.5 mtmt -109.45 141.51 41.77 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.283 -1.128 . . . . 0.0 109.546 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 109.295 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.8 p . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -120.76 176.58 5.46 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.1 -1.0 . . . . 0.0 110.294 -179.595 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -116.15 167.92 12.58 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -60.75 153.29 24.64 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.022 -1.281 . . . . 0.0 109.514 -179.737 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.67 -0.24 2.33 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.19 26.59 0.44 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.641 -1.505 . . . . 0.0 110.711 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 55.52 159.7 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 O-C-N 120.932 -1.105 . . . . 0.0 110.506 -179.765 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -162.88 -179.17 6.59 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 6.2 m -90.95 -50.22 5.99 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.764 -1.21 . . . . 0.0 108.808 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.509 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 175.26 -76.9 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.775 -0.578 . . . . 0.0 109.689 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.05 31.48 6.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.116 -0.99 . . . . 0.0 109.607 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.424 ' O ' ' C ' ' A' ' 13' ' ' TYR . 1.7 mmm -74.93 -4.98 41.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.26 -0.9 . . . . 0.0 109.44 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.424 ' C ' ' O ' ' A' ' 12' ' ' MET . 6.3 m-85 43.31 54.11 5.25 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.257 -0.902 . . . . 0.0 109.575 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.431 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -95.5 -20.55 18.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.228 -0.92 . . . . 0.0 109.129 179.766 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.4 m -56.89 121.73 10.59 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.588 1.185 . . . . 0.0 109.511 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.29 -36.15 41.08 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.011 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.0 t -146.25 78.43 1.52 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.167 -0.958 . . . . 0.0 109.757 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 146.94 -170.94 27.78 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.691 -1.364 . . . . 0.0 109.691 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.0 OUTLIER -121.91 -162.29 0.98 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.258 -1.142 . . . . 0.0 109.074 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 38.9 m -97.5 149.4 22.22 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.872 -1.142 . . . . 0.0 110.144 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 24' ' ' LYS . 31.7 mtt180 -146.31 136.76 23.94 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 50.08 26.14 1.98 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.183 -0.948 . . . . 0.0 109.244 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.1 31.16 39.63 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.7 mtmt -145.33 157.81 43.96 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.295 -1.12 . . . . 0.0 110.067 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.784 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.7 p . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.352 0.596 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 1.9 mptt -94.58 160.22 14.73 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.39 -0.819 . . . . 0.0 109.586 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 25' ' ' CYS . . . -112.07 169.55 13.17 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HA ' ' CB ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -44.91 166.83 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.288 -1.125 . . . . 0.0 109.238 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.49 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 58.94 15.27 27.52 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.516 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.98 14.0 1.25 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.26 -1.141 . . . . 0.0 111.135 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER 30.19 45.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 121.703 0.764 . . . . 0.0 110.4 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -54.47 -178.68 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -179.558 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.597 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.6 -45.99 8.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.716 -1.24 . . . . 0.0 109.334 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 9' ' ' SER . 3.7 mtt180 178.63 -94.57 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.56 -0.713 . . . . 0.0 109.747 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -90.58 43.08 1.13 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.112 -0.993 . . . . 0.0 109.705 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.447 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 2.9 mmt -75.75 -19.04 59.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.237 -0.914 . . . . 0.0 109.389 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 49.07 41.82 19.99 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.17 -0.956 . . . . 0.0 109.667 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.47 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 58.8 m-20 -102.69 -20.57 14.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 65.1 m -50.1 117.18 2.19 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 122.326 1.06 . . . . 0.0 110.332 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -48.91 -27.65 3.24 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.419 179.203 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.501 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.1 t -98.88 -118.55 0.14 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.476 -0.765 . . . . 0.0 109.742 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.501 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -71.65 -114.09 0.05 OUTLIER Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 p -128.35 -168.12 1.86 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.333 -1.098 . . . . 0.0 109.735 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 38.3 m -69.32 150.6 47.18 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.339 -0.851 . . . . 0.0 109.991 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -128.54 123.59 33.87 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER 45.1 26.18 0.22 Allowed 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.576 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 99.97 -36.67 3.95 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.49 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 3.6 mtmm -92.01 141.27 28.8 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.224 -1.162 . . . . 0.0 109.104 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.532 ' CB ' ' HA ' ' A' ' 4' ' ' LYS . 1.7 m . . . . . 0 C--N 1.298 -1.647 0 O-C-N 121.577 -0.702 . . . . 0.0 109.609 -179.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.3 p . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.295 0.569 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtp -116.84 174.38 6.12 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.19 -0.944 . . . . 0.0 110.004 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.432 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -118.71 177.71 16.5 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.403 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.4 mtpt -60.48 147.61 40.61 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.08 -1.247 . . . . 0.0 110.063 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.93 -14.7 51.79 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.98 64.09 2.41 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.435 -1.038 . . . . 0.0 109.25 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.561 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.5 OUTLIER -11.49 128.33 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.802 0.81 . . . . 0.0 112.168 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.589 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.02 -178.51 3.52 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -179.685 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.83 -66.28 0.94 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 120.98 -1.075 . . . . 0.0 108.601 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ptt180 168.82 108.9 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 7.2 mt 70.19 12.5 7.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.871 -0.518 . . . . 0.0 110.401 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.452 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 8.6 mtt -67.24 -29.61 69.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.097 -1.002 . . . . 0.0 109.117 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.452 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.5 m-85 64.74 65.95 0.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.798 . . . . 0.0 110.223 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -118.62 -19.1 8.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -0.85 . . . . 0.0 109.134 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.5 m -60.59 123.95 18.92 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.495 1.14 . . . . 0.0 109.673 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -55.84 -41.55 74.46 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.702 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.8 89.41 2.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 109.528 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.03 -168.61 22.89 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -128.61 -167.37 1.76 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.138 -1.213 . . . . 0.0 109.682 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 35.2 m -84.5 96.37 9.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.189 -0.945 . . . . 0.0 109.682 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' N ' ' O ' ' A' ' 24' ' ' LYS . 11.1 ptp180 -102.84 137.19 41.38 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.95 -1.094 . . . . 0.0 108.913 179.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.85 19.04 10.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.154 -0.966 . . . . 0.0 109.116 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.18 -9.12 74.02 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 28.4 mtmt -111.74 173.21 6.46 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.171 -1.194 . . . . 0.0 109.764 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.8 OUTLIER . . . . . 0 C--N 1.298 -1.639 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.334 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.346 0.594 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 7.1 mmtm -131.08 169.11 16.32 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.183 -0.948 . . . . 0.0 110.437 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.84 166.46 14.8 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.5 pttm -50.21 154.85 1.09 Allowed 'General case' 0 C--N 1.306 -1.315 0 O-C-N 120.972 -1.31 . . . . 0.0 109.212 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.97 -20.31 36.94 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.533 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.91 68.74 4.03 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.376 -1.073 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.533 ' C ' ' O ' ' A' ' 6' ' ' ALA . 8.5 mttt -20.17 138.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.898 0.856 . . . . 0.0 112.38 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.605 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.39 -178.28 4.7 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 179.856 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.605 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 28.4 t -90.3 -73.35 0.53 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.737 -1.227 . . . . 0.0 108.13 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.582 ' CB ' ' CZ ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -167.82 17.88 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.536 -0.727 . . . . 0.0 110.459 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.568 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 157.7 36.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.418 -0.801 . . . . 0.0 109.494 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.414 ' O ' ' C ' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -82.54 8.68 11.08 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 109.518 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.454 ' CE1' HD23 ' A' ' 11' ' ' LEU . 8.0 m-85 44.28 49.51 7.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.532 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.493 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 6.0 p-10 -103.55 -35.3 8.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.211 -0.931 . . . . 0.0 109.534 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 4.0 m -61.11 125.14 22.65 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 122.349 1.071 . . . . 0.0 110.004 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -65.47 -33.19 75.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.884 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 1.3 t -117.94 -115.48 0.33 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -42.82 165.5 0.02 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.4 t -91.56 -174.46 3.89 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.308 -1.113 . . . . 0.0 109.555 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.2 m -61.18 105.18 0.46 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.324 -0.86 . . . . 0.0 109.46 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . 2.5 tmt_? -96.21 135.76 37.59 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.057 -1.027 . . . . 0.0 109.06 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.435 ' OG ' ' HD3' ' A' ' 21' ' ' ARG . 20.2 m 47.24 23.42 0.32 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.162 -0.961 . . . . 0.0 109.483 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.55 -20.26 49.35 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.596 -1.401 . . . . 0.0 109.596 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' A' ' 21' ' ' ARG . 4.8 mtmp? -101.72 148.5 25.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -1.146 . . . . 0.0 109.716 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.449 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.1 m . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.4 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.261 0.553 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 28.5 mmtm -112.55 164.77 12.91 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -104.74 167.34 15.29 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -52.0 153.03 2.81 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.141 -1.211 . . . . 0.0 110.086 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.478 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 60.74 3.92 3.7 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.54 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.94 20.66 0.76 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.805 -1.409 . . . . 0.0 110.903 -179.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.54 ' O ' ' O ' ' A' ' 6' ' ' ALA . 13.4 mtpt 52.66 123.34 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 122.688 1.232 . . . . 0.0 111.379 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.08 -178.47 3.51 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.121 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.565 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -92.26 35.68 1.0 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.054 -1.029 . . . . 0.0 109.531 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 78.14 -54.83 0.5 Allowed 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.018 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.93 43.21 0.97 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.088 -1.007 . . . . 0.0 109.711 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.501 ' HB2' ' CB ' ' A' ' 9' ' ' SER . 0.1 OUTLIER -93.54 -3.89 52.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.0 109.555 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 55.89 55.86 6.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.249 -0.907 . . . . 0.0 109.766 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -102.89 -23.0 13.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.21 -0.931 . . . . 0.0 109.352 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.9 m -55.55 121.38 8.92 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 122.37 1.081 . . . . 0.0 109.629 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -48.07 -50.08 29.41 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.653 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.506 ' CG2' ' O ' ' A' ' 17' ' ' THR . 10.2 t -141.26 89.3 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.282 -0.886 . . . . 0.0 109.454 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.02 -173.42 28.07 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 m -121.35 -175.18 3.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -1.175 . . . . 0.0 109.5 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.0 m -93.43 131.53 38.54 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.257 -0.902 . . . . 0.0 109.747 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.2 ttp180 -119.6 119.78 34.77 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.322 -0.862 . . . . 0.0 109.235 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 59.03 15.38 3.97 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.352 -0.843 . . . . 0.0 109.577 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.04 -16.2 39.31 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.881 -1.287 . . . . 0.0 109.881 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.478 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 6.0 mtpt -94.98 154.57 17.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.232 -1.157 . . . . 0.0 109.468 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.037 -1.04 . . . . 0.0 109.494 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.275 0.56 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 39.3 mmtt -119.05 -178.99 3.69 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.083 -1.011 . . . . 0.0 110.108 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.493 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -140.4 163.25 26.45 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.72 149.34 0.62 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.914 -1.344 . . . . 0.0 109.643 -179.727 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 92.35 -39.41 3.01 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.53 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.62 78.15 0.43 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.365 -1.079 . . . . 0.0 108.145 178.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.9 ptpp? -34.8 159.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.416 0.627 . . . . 0.0 110.265 -179.229 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.592 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -138.84 -175.07 4.02 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -179.61 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.592 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -89.79 -47.29 8.0 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.688 -1.257 . . . . 0.0 108.696 -179.764 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.556 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 173.44 -73.09 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.533 -0.73 . . . . 0.0 110.302 178.634 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.28 58.37 0.82 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.02 -1.05 . . . . 0.0 110.279 -179.272 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmt -101.36 -14.6 17.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.037 -1.039 . . . . 0.0 108.7 178.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 50.37 68.21 0.8 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.396 -0.815 . . . . 0.0 109.925 179.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.401 ' HB3' ' CG ' ' A' ' 2' ' ' LYS . 3.9 m-20 -115.35 -21.5 9.82 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 108.79 179.238 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -60.15 123.06 16.01 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.627 1.203 . . . . 0.0 109.188 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.75 -32.84 14.62 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.25 -179.681 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 p -138.62 122.08 17.24 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.907 . . . . 0.0 109.601 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.62 -156.83 26.02 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.6 t -138.5 -179.8 6.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.274 -1.133 . . . . 0.0 109.357 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.496 ' N ' ' OG ' ' A' ' 19' ' ' SER . 19.6 m -59.21 111.2 1.26 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.526 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 24' ' ' LYS . 15.3 tpt180 -103.77 127.52 51.24 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.995 -1.065 . . . . 0.0 109.134 179.345 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 69.59 14.83 8.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.328 -179.684 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.38 -16.76 59.49 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.7 mtpt -114.05 175.55 5.42 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.229 -1.16 . . . . 0.0 109.63 -179.884 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.486 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--N 1.303 -1.456 0 C-N-CA 119.083 -1.047 . . . . 0.0 108.61 179.656 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.208 0.528 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtm -107.73 166.93 10.32 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.293 -0.879 . . . . 0.0 109.945 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.46 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -102.89 -178.12 26.73 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.904 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -60.75 154.85 20.63 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.064 -1.256 . . . . 0.0 110.555 -179.585 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.403 ' HA2' ' HB2' ' A' ' 24' ' ' LYS . . . 45.91 18.47 0.26 Allowed Glycine 0 N--CA 1.494 2.526 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.14 25.88 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.951 -1.323 . . . . 0.0 110.607 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.2 mtmp? 55.25 150.79 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 122.126 0.965 . . . . 0.0 111.266 179.918 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -156.68 177.08 11.89 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.623 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.553 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -92.0 -44.97 8.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.089 -1.007 . . . . 0.0 108.392 179.196 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.469 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 3.3 ttp180 168.17 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.8 0 O-C-N 121.667 -0.645 . . . . 0.0 109.653 179.053 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.39 27.21 4.77 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.065 -1.022 . . . . 0.0 109.87 -179.878 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.5 -10.59 46.14 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.865 . . . . 0.0 109.787 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 55.84 59.77 3.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.203 -0.936 . . . . 0.0 109.402 -179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.46 -24.05 10.39 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.404 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.3 m -59.56 122.05 13.08 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 122.7 1.238 . . . . 0.0 110.056 -179.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -57.9 -20.29 35.99 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.743 179.673 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.9 t -154.57 123.62 6.33 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.7 175.31 50.68 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -169.62 1.67 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.294 -1.121 . . . . 0.0 109.599 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.7 m -75.25 146.48 41.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.152 -0.967 . . . . 0.0 109.446 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.459 ' O ' ' HB3' ' A' ' 22' ' ' SER . 0.0 OUTLIER -135.33 117.03 14.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.287 -0.883 . . . . 0.0 109.483 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 7.3 t 71.12 4.51 5.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.487 -0.758 . . . . 0.0 109.655 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.36 -1.36 28.03 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -123.37 176.3 6.22 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.348 -1.089 . . . . 0.0 109.191 179.841 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.3 -1.568 0 O-C-N 121.416 -0.802 . . . . 0.0 109.684 179.917 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.294 0.568 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.6 mmmm -106.47 -156.9 0.59 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.357 -0.839 . . . . 0.0 109.661 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.47 ' O ' ' HB3' ' A' ' 6' ' ' ALA . . . -157.31 165.09 33.23 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.63 153.96 0.23 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 120.941 -1.329 . . . . 0.0 109.822 -179.687 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.468 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 86.92 -42.35 3.15 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.773 -1.731 . . . . 0.0 108.773 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -67.73 73.55 0.17 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.43 -1.041 . . . . 0.0 108.253 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.73 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -35.26 158.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.555 0.693 . . . . 0.0 110.478 -178.82 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.11 -177.8 4.46 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.806 -178.618 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.572 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -91.77 34.96 0.97 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.311 -0.868 . . . . 0.0 109.725 -179.246 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.572 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 87.89 -75.62 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.638 179.347 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.99 42.88 2.71 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.905 -1.122 . . . . 0.0 110.714 -178.897 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.442 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -83.15 -21.8 33.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.95 -1.094 . . . . 0.0 108.586 179.16 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 56.96 71.87 0.55 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.546 -0.721 . . . . 0.0 110.071 179.436 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.442 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 2.2 m-20 -122.95 -15.26 7.42 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.282 -0.886 . . . . 0.0 109.725 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.4 m -67.6 122.3 17.74 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.559 1.171 . . . . 0.0 109.73 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.73 -43.12 47.52 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.362 179.895 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 18' ' ' GLY . 6.6 p -88.66 -116.26 0.06 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.047 -1.033 . . . . 0.0 109.645 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.96 -144.56 0.01 OUTLIER Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -124.17 -148.89 0.41 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.162 -1.199 . . . . 0.0 109.445 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.3 m -79.52 110.8 15.18 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.335 -0.853 . . . . 0.0 109.518 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -102.45 138.22 39.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 109.113 179.536 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 t 47.71 27.58 1.09 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.223 -179.646 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.4 -17.01 41.22 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.73 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -102.49 157.67 16.76 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.254 -1.145 . . . . 0.0 109.482 -179.906 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.483 0 C-N-CA 118.831 -1.148 . . . . 0.0 108.305 179.186 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.452 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 11.8 p . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 8.8 mmtt -128.26 173.14 10.4 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.048 -1.032 . . . . 0.0 110.514 -179.204 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.83 162.46 12.36 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.476 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.482 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -55.18 156.08 4.37 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 120.943 -1.327 . . . . 0.0 109.32 -179.911 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.39 -28.19 10.4 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.24 75.96 3.79 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 121.544 -0.974 . . . . 0.0 108.711 179.328 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -29.79 146.35 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 121.554 0.692 . . . . 0.0 110.766 -179.607 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -126.76 -175.2 3.34 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -179.549 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.42 -52.34 4.96 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.802 -1.186 . . . . 0.0 108.994 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.538 ' CB ' ' O ' ' A' ' 9' ' ' SER . 31.5 ttm180 158.35 100.98 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 76.08 14.44 2.54 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.675 -0.641 . . . . 0.0 109.468 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.43 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mtp -61.23 -21.28 63.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.4 -0.812 . . . . 0.0 108.869 179.54 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD2' ' O ' ' A' ' 11' ' ' LEU . 53.8 m-85 60.3 68.63 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.313 -0.867 . . . . 0.0 109.891 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -127.18 -30.88 2.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.922 . . . . 0.0 109.606 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -50.53 124.62 11.1 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.01 -1.057 . . . . 0.0 109.036 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -58.22 -27.84 64.31 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.13 -179.713 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.43 ' CG2' ' O ' ' A' ' 17' ' ' THR . 5.3 t -131.47 92.97 3.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.657 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.76 -150.65 16.92 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.85 173.59 11.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.401 -1.058 . . . . 0.0 109.281 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.1 m -45.24 135.64 5.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.447 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.416 ' HG3' HH11 ' A' ' 21' ' ' ARG . 19.3 ttm-85 -115.94 118.59 33.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 109.377 179.787 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 44.88 25.35 0.15 Allowed 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.391 -0.818 . . . . 0.0 109.982 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.65 -43.02 1.8 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -92.78 152.14 19.63 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.078 -1.248 . . . . 0.0 110.416 -179.125 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.482 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.51 0 O-C-N 121.397 -0.814 . . . . 0.0 109.203 179.788 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.238 0.542 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . 9.4 mmtp -115.57 178.42 4.31 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.231 -0.918 . . . . 0.0 110.336 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.458 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.54 169.82 17.47 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.579 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -40.1 149.88 0.06 Allowed 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.362 -1.081 . . . . 0.0 110.213 -179.767 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 89.28 -42.71 3.02 Favored Glycine 0 N--CA 1.487 2.055 0 N-CA-C 108.726 -1.75 . . . . 0.0 108.726 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.525 ' CB ' ' HB3' ' A' ' 2' ' ' LYS . . . -64.99 74.79 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.4 -1.059 . . . . 0.0 108.605 179.335 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.27 150.31 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.865 0.841 . . . . 0.0 111.116 -179.748 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -134.69 176.72 8.38 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.198 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.579 ' O ' ' C ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -92.49 112.99 25.14 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.692 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.579 ' C ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -13.6 88.39 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.267 0 CA-C-O 121.443 0.64 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.533 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 2.0 tt 79.59 106.3 0.07 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.682 -0.636 . . . . 0.0 109.789 -179.689 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.566 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -159.63 -35.34 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.503 -0.748 . . . . 0.0 109.452 179.626 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.566 ' CD2' ' O ' ' A' ' 12' ' ' MET . 13.5 m-85 86.51 44.59 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.802 -0.561 . . . . 0.0 110.352 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.448 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 1.1 m-20 -102.4 -36.06 8.57 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.697 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.1 m -58.11 124.96 21.14 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.455 1.121 . . . . 0.0 108.733 179.106 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.17 -27.43 63.82 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.669 -179.613 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -144.07 -81.45 0.18 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.219 -0.926 . . . . 0.0 110.046 -179.628 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.491 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -41.12 163.87 0.01 OUTLIER Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -179.486 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.54 171.32 7.43 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -1.156 . . . . 0.0 109.718 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.4 m -75.11 89.66 2.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.231 -0.918 . . . . 0.0 109.513 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -108.42 142.01 39.42 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.013 -1.054 . . . . 0.0 109.631 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.34 37.35 18.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.409 -0.807 . . . . 0.0 108.936 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.73 9.8 47.13 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -179.513 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 30.0 mtpt -117.99 141.06 48.86 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 121.292 -1.122 . . . . 0.0 110.342 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.513 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--N 1.302 -1.478 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.081 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 15.7 mmtt -126.35 171.57 10.86 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.329 -0.857 . . . . 0.0 110.237 -179.744 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.49 176.12 16.02 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.027 -1.629 . . . . 0.0 109.027 179.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -55.47 150.21 12.24 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.001 -1.293 . . . . 0.0 109.687 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.53 -28.27 16.24 Favored Glycine 0 N--CA 1.487 2.042 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -179.27 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.525 ' CB ' ' HD2' ' A' ' 2' ' ' LYS . . . -69.48 73.57 0.36 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.679 -0.895 . . . . 0.0 108.671 179.214 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.84 150.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.188 0.518 . . . . 0.0 110.021 -179.768 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -163.58 -167.53 1.44 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.163 -0.961 . . . . 0.0 110.266 -179.44 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.53 -93.19 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.263 -0.898 . . . . 0.0 109.774 -179.532 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.8 OUTLIER -170.88 115.48 0.44 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.406 -0.809 . . . . 0.0 109.341 -179.748 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 80.37 13.99 0.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.624 -0.673 . . . . 0.0 109.346 -179.916 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.459 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -60.75 -21.79 63.37 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.31 -0.868 . . . . 0.0 109.212 179.84 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 3.6 m-85 63.9 52.28 2.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.432 -0.792 . . . . 0.0 110.261 179.448 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -121.65 -29.46 4.36 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.077 -1.015 . . . . 0.0 109.478 179.51 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 3.9 m -57.29 123.79 16.6 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.362 1.077 . . . . 0.0 109.382 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -56.33 -28.42 58.86 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.909 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.411 ' O ' HG21 ' A' ' 17' ' ' THR . 4.6 t -142.64 112.65 7.02 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.908 . . . . 0.0 109.372 -179.985 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.58 -144.41 15.82 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.1 p -151.39 176.68 11.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.186 -1.185 . . . . 0.0 109.778 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 7.9 m -88.7 103.47 15.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.383 -0.823 . . . . 0.0 109.322 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 22' ' ' SER . 44.2 mtp180 -116.64 143.26 45.84 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.303 -179.377 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 79.35 -36.26 0.17 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 109.926 -179.867 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.477 ' C ' ' HG3' ' A' ' 24' ' ' LYS . . . 143.77 -3.01 1.51 Allowed Glycine 0 N--CA 1.487 2.09 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 179.928 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mtmt -141.46 148.64 39.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.706 -1.467 . . . . 0.0 110.764 -179.658 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.559 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.762 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.449 ' C ' ' HD2' ' A' ' 2' ' ' LYS . 17.5 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.334 0.588 . . . . 0.0 109.804 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.589 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 2.0 mptp? -105.13 178.42 4.57 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.422 -0.799 . . . . 0.0 109.915 -179.671 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.7 169.66 22.72 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 108.63 -1.788 . . . . 0.0 108.63 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 8.0 ptmt -53.07 154.33 3.07 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 120.914 -1.344 . . . . 0.0 109.038 -179.995 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.9 -26.87 12.53 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.898 -2.081 . . . . 0.0 107.898 -178.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.88 75.89 3.48 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.936 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -30.49 148.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.35 0.595 . . . . 0.0 110.243 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.585 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -164.67 -162.24 0.63 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.042 -1.036 . . . . 0.0 110.057 -179.648 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.512 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 1.0 OUTLIER -92.32 -141.14 0.2 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.853 -1.154 . . . . 0.0 109.22 -179.567 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -103.05 -64.2 1.1 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.032 -1.042 . . . . 0.0 109.99 -179.566 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.01 50.08 0.87 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.172 -0.955 . . . . 0.0 110.135 -179.573 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.512 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -80.13 -36.66 34.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.148 -0.97 . . . . 0.0 109.034 179.379 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' MET . 29.8 m-85 61.47 48.14 6.12 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.424 -0.798 . . . . 0.0 110.066 179.461 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.473 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -110.04 -11.1 14.66 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.178 -0.951 . . . . 0.0 109.04 179.387 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.9 m -69.07 122.53 18.92 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.339 1.066 . . . . 0.0 109.281 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -46.88 -54.78 9.24 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.988 -179.817 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 t -133.51 54.75 1.93 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.98 . . . . 0.0 109.454 -179.908 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -172.04 -158.06 15.32 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 179.938 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.6 m -143.03 170.07 16.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.173 -1.192 . . . . 0.0 109.683 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 9' ' ' SER . 64.1 m -93.5 85.32 4.89 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.479 -0.763 . . . . 0.0 108.998 179.767 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.528 ' O ' ' CB ' ' A' ' 22' ' ' SER . 31.8 ttp180 -100.25 134.04 43.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.616 -0.677 . . . . 0.0 109.558 -179.148 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER 79.56 -8.77 1.54 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.601 -0.687 . . . . 0.0 109.415 -179.517 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 116.69 -3.54 19.63 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.231 179.693 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -132.58 147.69 52.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.612 -1.523 . . . . 0.0 110.794 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.585 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.458 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.21 179.874 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.288 0.566 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.505 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -120.77 166.9 13.1 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.139 -0.975 . . . . 0.0 110.086 -179.77 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.507 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -102.69 162.98 16.35 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -179.929 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.4 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -54.31 161.81 1.25 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.211 -1.17 . . . . 0.0 109.85 -179.774 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.83 18.28 1.8 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.546 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.4 17.09 1.13 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.968 -1.313 . . . . 0.0 110.574 179.887 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.546 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER 52.68 129.26 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 122.53 1.157 . . . . 0.0 111.559 179.449 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.569 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.4 p -167.58 -168.69 1.06 Allowed 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.564 -0.71 . . . . 0.0 110.3 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 m -93.38 -129.95 0.13 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 109.553 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.542 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 16.6 tpt180 -137.77 109.67 7.18 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 120.807 -1.183 . . . . 0.0 109.419 -179.687 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.542 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 78.13 59.72 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.479 -0.763 . . . . 0.0 109.598 -179.993 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.4 mmm -118.28 -2.81 11.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 109.619 179.901 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 53.28 69.41 0.71 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.172 -0.955 . . . . 0.0 110.046 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.61 -29.86 1.32 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.327 -0.858 . . . . 0.0 109.772 179.559 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 5.6 m -60.42 121.12 11.3 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.452 1.12 . . . . 0.0 109.63 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.62 -35.57 21.55 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.108 -179.987 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.4 t -153.22 56.64 0.77 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.159 -0.963 . . . . 0.0 109.571 -179.898 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.25 -160.38 22.99 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.929 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.58 173.85 10.7 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.303 -1.116 . . . . 0.0 109.325 179.992 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 8.2 m -111.81 91.89 3.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.345 179.86 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.539 ' O ' ' CB ' ' A' ' 22' ' ' SER . 2.2 ttm180 -126.67 153.68 45.08 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.405 -0.809 . . . . 0.0 109.204 -179.458 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 78.69 -35.15 0.17 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.335 -0.853 . . . . 0.0 110.111 -179.961 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.31 -4.96 1.36 Allowed Glycine 0 N--CA 1.486 2.021 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.309 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HB3' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -146.65 162.74 37.82 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.594 -1.533 . . . . 0.0 110.431 -179.914 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.569 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.002 -179.548 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.297 0.57 . . . . 0.0 109.676 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.2 mmtt -122.72 172.68 8.25 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.306 -0.871 . . . . 0.0 110.413 -179.261 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -127.67 163.75 21.29 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.743 -1.743 . . . . 0.0 108.743 179.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.45 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 4.4 pttt -49.77 154.88 0.94 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.885 -1.362 . . . . 0.0 109.071 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.401 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.05 -31.51 6.57 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.766 -2.134 . . . . 0.0 107.766 -178.724 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.71 74.45 0.42 Allowed 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.02 148.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.386 0.612 . . . . 0.0 110.58 -179.369 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.567 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.9 OUTLIER -170.08 -169.37 0.85 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.871 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 10.3 t -93.8 160.49 14.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.943 . . . . 0.0 109.927 -179.354 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.545 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 10.1 ttp180 -72.42 71.45 0.93 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.348 179.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.545 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 159.45 -16.24 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.732 -0.605 . . . . 0.0 110.238 179.801 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.466 ' C ' ' O ' ' A' ' 11' ' ' LEU . 4.0 mmm -38.48 -47.19 1.25 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.378 -0.826 . . . . 0.0 109.697 -179.772 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 58.86 26.24 14.61 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 109.531 179.734 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' CE ' ' A' ' 12' ' ' MET . 71.7 m-20 -95.26 -6.32 41.67 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.088 -1.007 . . . . 0.0 109.2 179.611 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.5 m -60.9 126.47 27.5 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.478 1.132 . . . . 0.0 109.089 179.608 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.28 -22.91 0.28 Allowed 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.403 -179.578 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -137.22 -85.88 0.31 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.942 -1.099 . . . . 0.0 110.052 179.867 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.479 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -57.23 -153.54 0.01 OUTLIER Glycine 0 N--CA 1.491 2.361 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.434 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 83.5 p -129.65 -166.04 1.61 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.317 -1.108 . . . . 0.0 109.812 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 21.4 m -98.3 93.79 6.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.257 -0.902 . . . . 0.0 109.773 -179.711 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 22' ' ' SER . 27.4 ttp180 -112.97 156.58 22.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.552 -0.717 . . . . 0.0 109.33 -179.431 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 31.4 t 63.22 10.68 4.79 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.243 -0.911 . . . . 0.0 109.338 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 94.58 -5.75 70.36 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.967 -1.111 . . . . 0.0 110.368 179.647 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -136.07 154.54 50.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.675 -1.485 . . . . 0.0 110.93 -179.249 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.567 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.066 179.587 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.305 0.574 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.3 mmtp -112.6 176.12 5.15 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.231 -0.918 . . . . 0.0 109.89 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.407 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -113.78 159.08 13.89 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.175 -1.57 . . . . 0.0 109.175 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.419 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -52.47 159.0 1.09 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.24 -1.153 . . . . 0.0 110.075 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.95 15.74 1.06 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.675 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.07 23.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.786 -1.42 . . . . 0.0 110.702 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER 55.34 154.67 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.177 -0.952 . . . . 0.0 110.729 -179.759 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.8 p 163.45 -168.37 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.554 -0.716 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.432 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 1.5 t -92.35 -139.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.45 -0.781 . . . . 0.0 109.561 -179.243 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.576 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER -137.74 114.48 10.55 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.023 -1.048 . . . . 0.0 109.722 -179.455 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.576 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.92 6.67 0.28 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.087 0.47 . . . . 0.0 110.472 179.442 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.418 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -66.52 -30.1 70.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.99 -1.069 . . . . 0.0 108.364 178.962 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.418 ' HB2' ' O ' ' A' ' 12' ' ' MET . 1.1 m-85 65.35 66.25 0.54 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.536 -0.728 . . . . 0.0 110.166 179.535 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 4.8 p-10 -124.65 -1.3 7.98 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.875 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 4.0 m -81.99 124.74 30.04 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 122.448 1.118 . . . . 0.0 110.275 -179.978 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -50.5 -23.59 2.59 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.359 178.618 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 17' ' ' THR . 9.7 t -153.85 129.73 10.18 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.632 -0.667 . . . . 0.0 109.22 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.0 -145.44 17.72 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.5 m -144.48 -161.35 1.27 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -1.139 . . . . 0.0 109.216 179.984 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.471 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 1.3 m -119.71 85.9 2.46 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.139 -0.975 . . . . 0.0 110.129 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -117.97 -176.28 3.01 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.769 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 48.27 23.36 0.54 Allowed 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.115 -0.991 . . . . 0.0 109.267 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.3 6.96 76.89 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.0 mttt -146.49 160.53 41.98 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.871 -1.37 . . . . 0.0 110.705 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.773 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.9 mmtp -137.69 176.21 8.9 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.072 -1.017 . . . . 0.0 110.491 -179.439 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -119.98 175.68 15.96 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.579 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -57.34 153.55 12.18 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.801 -1.411 . . . . 0.0 109.196 179.888 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.22 -29.95 10.84 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.928 -2.069 . . . . 0.0 107.928 -178.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.93 74.13 0.45 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.581 -0.952 . . . . 0.0 108.444 178.977 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.541 ' HA ' ' CB ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -32.51 152.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.407 0.622 . . . . 0.0 110.489 -179.442 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -169.76 -165.57 0.51 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.183 -0.948 . . . . 0.0 110.266 -179.614 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.416 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 39.7 m -92.76 -121.36 0.09 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.258 -0.901 . . . . 0.0 109.393 -179.424 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.517 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 12.8 mtm180 -143.23 115.48 8.45 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.678 -1.264 . . . . 0.0 109.415 -179.93 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.531 ' N ' HD23 ' A' ' 11' ' ' LEU . 1.3 mt 77.06 31.3 0.51 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.711 -0.618 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.48 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -78.92 -19.08 52.69 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.502 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.455 ' HB2' ' O ' ' A' ' 12' ' ' MET . 25.1 m-85 63.63 58.7 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.55 -0.719 . . . . 0.0 111.418 178.486 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.516 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -126.51 -14.81 5.73 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.945 -1.097 . . . . 0.0 109.717 179.095 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.2 m -73.51 129.37 37.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.296 1.045 . . . . 0.0 109.836 -179.943 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -60.87 -18.61 57.17 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.038 -179.743 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 18' ' ' GLY . 25.9 p -117.73 -111.56 0.34 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.113 -0.992 . . . . 0.0 109.257 -179.963 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -150.15 0.01 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 179.981 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.7 p -114.52 -165.98 1.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.345 -1.091 . . . . 0.0 109.65 -179.875 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 1.8 m -87.8 96.67 10.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.304 -0.872 . . . . 0.0 109.715 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -107.48 168.72 9.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.574 -0.704 . . . . 0.0 109.223 -179.679 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t 51.42 20.24 0.96 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.03 -1.044 . . . . 0.0 109.013 -179.52 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.466 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 78.35 2.77 84.79 Favored Glycine 0 N--CA 1.487 2.088 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.855 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.541 ' CB ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mttm -140.0 151.67 45.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.931 -1.335 . . . . 0.0 110.379 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.562 0 C-N-CA 119.91 -0.716 . . . . 0.0 109.41 179.816 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.1 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.511 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.6 mmmt -114.07 171.43 7.61 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.168 -0.958 . . . . 0.0 110.372 -179.36 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -119.3 149.13 18.12 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HG2' ' C ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -44.79 158.4 0.06 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.132 -1.216 . . . . 0.0 109.952 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.04 -2.75 24.76 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.569 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.02 23.26 0.47 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.923 -1.34 . . . . 0.0 111.054 -179.82 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.4 ptmm? 46.93 175.64 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.537 -0.727 . . . . 0.0 109.66 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.577 ' CB ' ' O ' ' A' ' 7' ' ' LYS . 3.7 p 150.8 -172.73 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 CA-C-O 121.394 0.616 . . . . 0.0 109.754 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 13.9 t -93.35 -132.42 0.15 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.854 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.498 ' HA ' ' O ' ' A' ' 20' ' ' CYS . 6.7 ptt180 -120.66 -24.65 5.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.732 -1.23 . . . . 0.0 109.861 179.999 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.446 HD13 ' CG ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -108.86 8.96 26.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.195 -0.941 . . . . 0.0 109.51 -179.968 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.456 ' SD ' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -46.26 -49.83 16.8 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.28 -0.888 . . . . 0.0 109.345 179.971 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 54.11 29.22 9.99 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 109.554 179.965 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.456 ' OD2' ' SD ' ' A' ' 12' ' ' MET . 29.6 m-20 -100.98 -4.66 27.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.359 -0.838 . . . . 0.0 109.479 179.858 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -64.68 124.24 21.4 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.331 1.062 . . . . 0.0 109.301 179.572 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.69 -49.75 18.93 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.954 -179.889 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.9 72.72 1.5 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.14 -0.975 . . . . 0.0 109.506 -179.916 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.58 -165.77 34.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.5 p -129.99 -175.29 3.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.194 179.889 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.498 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -108.82 114.0 27.41 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.309 -0.87 . . . . 0.0 110.019 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' A' ' 22' ' ' SER . 24.3 mtp180 -145.21 149.34 34.76 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.735 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 80.07 -12.01 1.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.483 -0.761 . . . . 0.0 109.792 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.469 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . 118.53 -3.93 15.3 Favored Glycine 0 N--CA 1.488 2.157 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.286 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mtmt -146.54 164.55 32.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.732 -1.452 . . . . 0.0 111.417 -179.881 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.533 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.771 -179.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.1 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.324 0.583 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.7 mmmm -122.34 168.24 12.31 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.343 -0.848 . . . . 0.0 110.344 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.24 151.42 17.18 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -46.18 153.05 0.35 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.156 -1.203 . . . . 0.0 110.252 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.88 -18.74 5.74 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.502 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -78.23 46.45 0.61 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.761 -1.435 . . . . 0.0 110.703 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.593 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 52.53 164.15 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.221 -0.924 . . . . 0.0 110.824 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 5.0 p -161.17 170.53 20.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.527 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 6.7 t -98.71 -86.86 0.35 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.254 -0.904 . . . . 0.0 108.967 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' A' ' 9' ' ' SER . 13.1 mmm180 -156.72 -38.89 0.08 Allowed 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.15 42.14 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.288 -0.883 . . . . 0.0 109.325 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.527 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 79.9 mtp -83.38 -15.37 50.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.295 -0.878 . . . . 0.0 109.529 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 12' ' ' MET . 12.9 m-85 74.9 49.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.446 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -99.32 -38.93 8.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.304 -0.873 . . . . 0.0 109.163 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 8.1 m -54.96 122.84 11.77 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 122.381 1.086 . . . . 0.0 109.658 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -63.12 -37.95 89.25 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.661 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.46 ' O ' ' O ' ' A' ' 18' ' ' GLY . 41.7 p -104.53 -99.69 0.32 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.299 -0.876 . . . . 0.0 109.465 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.46 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -60.93 -143.25 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.5 t -148.07 -162.88 1.64 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.25 -1.147 . . . . 0.0 109.532 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -46.74 132.2 11.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 110.225 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -146.18 128.86 16.18 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.41 -0.806 . . . . 0.0 109.141 179.09 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ARG . 46.7 t 44.15 25.97 0.13 Allowed 'General case' 0 C--N 1.296 -1.734 0 O-C-N 121.463 -0.773 . . . . 0.0 109.863 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.463 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 96.36 -26.44 21.44 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.593 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.5 mptp? -103.26 165.4 11.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.312 -1.111 . . . . 0.0 109.321 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.483 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -62.83 161.25 12.99 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.169 -0.957 . . . . 0.0 109.908 -179.474 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.4 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.302 -1.485 0 O-C-N 120.276 -1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.5 p . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.679 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.6 mmmt -109.13 -141.34 0.38 Allowed 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.3 -0.875 . . . . 0.0 109.678 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.473 ' O ' ' HB3' ' A' ' 25' ' ' CYS . . . -178.87 163.0 30.42 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.441 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -47.84 149.07 1.39 Allowed 'General case' 0 C--N 1.307 -1.269 0 O-C-N 120.896 -1.356 . . . . 0.0 109.275 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.74 -39.99 3.1 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 108.454 -1.859 . . . . 0.0 108.454 -179.148 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -67.32 71.41 0.11 Allowed 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.425 -1.044 . . . . 0.0 108.495 179.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.92 153.13 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.763 0.792 . . . . 0.0 110.697 -179.211 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -131.94 -174.81 3.53 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -179.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 4.0 m -90.33 -46.84 8.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.659 -1.276 . . . . 0.0 108.701 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 9' ' ' SER . 1.9 mmm180 179.2 -87.55 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.614 -0.678 . . . . 0.0 109.746 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.95 21.32 7.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.046 -1.034 . . . . 0.0 109.827 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.46 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -56.35 -25.3 48.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.244 -0.91 . . . . 0.0 109.184 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 48.07 64.9 1.46 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.359 -0.838 . . . . 0.0 109.788 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.46 ' OD1' ' O ' ' A' ' 12' ' ' MET . 1.1 m-20 -119.82 -24.77 6.05 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.18 -0.95 . . . . 0.0 109.541 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 4.1 m -53.45 120.79 6.54 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.42 1.105 . . . . 0.0 109.443 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -47.03 -35.14 6.42 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.694 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 38.7 p -85.89 -137.07 0.07 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -52.99 -105.06 0.01 OUTLIER Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.1 p -151.08 -158.26 0.9 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.038 -1.272 . . . . 0.0 109.785 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 7.2 m -68.03 137.27 54.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.368 -0.833 . . . . 0.0 109.698 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.464 ' O ' ' OG ' ' A' ' 22' ' ' SER . 12.9 ttp180 -125.92 125.08 42.18 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.232 -0.918 . . . . 0.0 109.091 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.464 ' OG ' ' O ' ' A' ' 21' ' ' ARG . 79.8 p 50.52 22.42 1.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.384 -0.823 . . . . 0.0 109.335 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.98 -19.76 53.0 Favored Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -100.47 140.96 33.98 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.378 -1.072 . . . . 0.0 109.409 179.881 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER -57.32 171.74 0.38 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.02 -1.05 . . . . 0.0 108.916 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 119.809 -1.807 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.253 0.549 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 20.6 mmtm -112.98 165.06 12.7 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.236 -0.915 . . . . 0.0 110.314 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.56 163.33 19.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -52.02 155.43 1.86 Allowed 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.175 -1.191 . . . . 0.0 110.152 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.416 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 59.62 8.24 7.13 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 18.34 0.88 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.852 -1.381 . . . . 0.0 110.587 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.04 154.13 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.189 -0.944 . . . . 0.0 110.713 -179.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -157.06 178.8 9.94 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.775 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 8.9 t -91.74 -45.43 8.43 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.831 -1.168 . . . . 0.0 108.646 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.434 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 176.91 -83.42 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.866 0 O-C-N 121.753 -0.592 . . . . 0.0 109.771 179.126 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.99 24.17 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.272 -0.893 . . . . 0.0 109.756 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 74.5 mmm -61.33 -16.53 46.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.051 -1.031 . . . . 0.0 109.256 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 58.25 60.96 2.45 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 0.0 109.572 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -106.81 -26.05 11.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.406 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -55.41 122.18 10.62 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 122.349 1.071 . . . . 0.0 109.562 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -53.68 -43.15 68.64 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.846 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.449 ' CG2' ' O ' ' A' ' 17' ' ' THR . 6.7 t -139.86 88.08 2.21 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 109.521 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.67 -162.53 26.61 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.3 p -132.7 -165.51 1.61 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.257 -1.143 . . . . 0.0 109.371 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 23.5 m -92.03 136.51 33.11 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.186 -0.946 . . . . 0.0 109.697 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -125.38 106.94 10.2 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.19 -0.944 . . . . 0.0 108.813 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.74 12.38 7.59 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 121.592 -0.693 . . . . 0.0 109.336 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.468 ' O ' ' HA ' ' A' ' 7' ' ' LYS . . . 112.26 -16.5 24.72 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.9 mtpt -94.19 145.8 24.45 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.615 -0.932 . . . . 0.0 109.356 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.07 175.97 3.47 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.113 -0.992 . . . . 0.0 109.454 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.368 0 O-C-N 119.95 -1.719 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.421 0.629 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 10.1 mptt -97.67 167.42 10.97 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.329 -0.857 . . . . 0.0 109.785 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.19 170.69 17.13 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.341 -1.904 . . . . 0.0 108.341 179.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.428 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -49.38 147.27 3.34 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.738 -1.448 . . . . 0.0 108.896 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.23 -31.7 6.17 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.03 75.48 0.93 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.587 -0.949 . . . . 0.0 108.465 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.77 152.46 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.219 0.533 . . . . 0.0 110.58 -179.448 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.603 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.3 -177.6 4.79 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.603 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m -91.24 -62.5 1.43 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.791 -1.193 . . . . 0.0 109.074 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.497 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 166.01 102.4 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.497 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.18 15.64 1.37 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.599 -0.688 . . . . 0.0 109.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.44 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 3.9 mmm -69.71 -18.99 63.57 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.281 -0.887 . . . . 0.0 109.367 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 12' ' ' MET . 43.8 m-85 60.53 66.96 0.87 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.318 -0.864 . . . . 0.0 109.169 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -123.3 -22.44 5.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.356 -0.84 . . . . 0.0 109.767 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -64.27 119.93 11.22 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 122.483 1.135 . . . . 0.0 110.315 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.87 -38.37 55.79 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.42 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.48 102.71 4.53 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.389 -0.819 . . . . 0.0 109.397 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.99 -166.68 12.77 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.3 p -128.85 173.18 10.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.129 -1.219 . . . . 0.0 109.435 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.5 m -60.64 102.68 0.2 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.274 -0.891 . . . . 0.0 109.492 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.545 ' N ' ' O ' ' A' ' 24' ' ' LYS . 34.4 ttp180 -99.9 139.88 34.93 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.155 -0.965 . . . . 0.0 109.118 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 18.75 6.23 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.081 -1.012 . . . . 0.0 109.353 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.38 -11.9 70.81 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.9 mtpp -119.71 170.04 9.56 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.084 -1.245 . . . . 0.0 109.569 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m -72.05 159.76 33.63 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.187 -0.946 . . . . 0.0 109.472 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.623 0 O-C-N 120.271 -1.518 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.7 p . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.402 0.62 . . . . 0.0 109.598 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 6.5 mmtp -119.33 -179.98 4.02 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.495 -0.753 . . . . 0.0 110.108 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -123.74 163.49 17.31 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -44.81 158.88 0.05 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.216 -1.167 . . . . 0.0 109.308 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 90.08 -34.57 4.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 108.869 -1.692 . . . . 0.0 108.869 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.467 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.5 72.57 0.99 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.381 -1.07 . . . . 0.0 108.449 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.654 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -35.52 156.18 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.179 0.514 . . . . 0.0 110.406 -179.159 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.26 -177.32 4.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.025 -1.047 . . . . 0.0 108.448 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.3 -62.51 1.42 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.898 -1.126 . . . . 0.0 109.256 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.52 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 167.9 96.94 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 O-C-N 121.564 -0.71 . . . . 0.0 109.923 179.418 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.84 54.56 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.579 -0.701 . . . . 0.0 109.547 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.413 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -108.31 -18.8 13.67 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' MET . 88.9 m-85 60.46 80.94 0.19 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB3' ' HG2' ' A' ' 2' ' ' LYS . 3.6 m-20 -144.93 -37.8 0.28 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.248 -0.908 . . . . 0.0 109.347 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -60.37 126.13 26.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.42 1.105 . . . . 0.0 108.661 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.559 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -59.43 -36.51 76.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 46.5 p -108.1 135.91 48.66 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.057 -1.027 . . . . 0.0 109.513 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 51.12 -150.4 6.61 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.63 -164.13 1.45 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.393 -1.063 . . . . 0.0 109.469 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -61.28 107.72 0.81 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.465 -0.772 . . . . 0.0 109.854 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -97.17 137.99 35.36 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.004 -1.06 . . . . 0.0 109.05 179.313 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.6 20.77 1.14 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.363 -0.836 . . . . 0.0 109.275 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.7 -16.73 60.1 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.654 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 61.2 mttt -106.06 174.08 6.04 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.11 -1.229 . . . . 0.0 110.157 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -73.4 162.65 29.06 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.92 -1.112 . . . . 0.0 108.819 179.664 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.493 0 O-C-N 120.103 -1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.0 mmtt -134.04 168.48 18.73 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.123 -0.986 . . . . 0.0 110.377 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.453 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -100.79 170.05 21.63 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.431 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -60.8 159.81 10.5 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.157 -1.202 . . . . 0.0 109.918 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 60.22 8.39 8.77 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.502 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.37 15.96 1.45 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.914 -1.345 . . . . 0.0 110.412 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.89 153.85 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.862 0.839 . . . . 0.0 110.675 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.609 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -159.64 -177.94 6.74 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.41 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.609 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.2 -56.0 3.39 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 120.875 -1.141 . . . . 0.0 108.563 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CB ' ' O ' ' A' ' 9' ' ' SER . 1.1 ptm180 159.33 101.15 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 121.306 0.574 . . . . 0.0 109.655 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.55 51.96 0.46 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.679 -0.638 . . . . 0.0 109.799 179.668 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.49 ' CB ' ' OD2' ' A' ' 14' ' ' ASP . 1.9 mtp -106.28 -7.56 17.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.373 -0.83 . . . . 0.0 109.275 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 54.19 51.6 14.16 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.457 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.49 ' OD2' ' CB ' ' A' ' 12' ' ' MET . 9.3 m-20 -104.62 -14.46 15.61 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.478 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.9 m -67.18 124.53 23.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 122.496 1.141 . . . . 0.0 109.706 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -59.84 -9.91 3.39 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.489 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.3 p -133.14 1.6 3.53 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.713 -1.242 . . . . 0.0 111.093 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -178.1 -145.2 5.86 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.159 -1.496 . . . . 0.0 110.41 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -119.74 -171.02 2.05 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.392 -1.064 . . . . 0.0 109.326 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -70.29 142.14 52.29 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 110.172 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.462 ' O ' ' OG ' ' A' ' 22' ' ' SER . 0.2 OUTLIER -125.24 125.39 43.51 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.655 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 21' ' ' ARG . 31.0 p 54.94 17.94 2.03 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.553 -0.717 . . . . 0.0 109.465 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.94 -45.71 1.28 Allowed Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.902 -1.279 . . . . 0.0 109.902 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.5 mttt -93.52 162.14 14.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.281 -1.129 . . . . 0.0 109.758 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.9 OUTLIER -64.76 171.01 3.66 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.641 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.403 0 O-C-N 119.875 -1.766 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 3.9 mmtm -127.29 174.73 8.72 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -120.04 168.49 13.74 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.454 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -48.49 154.45 0.64 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.882 -1.364 . . . . 0.0 109.515 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.78 -40.04 2.84 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.536 -2.226 . . . . 0.0 107.536 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.19 78.61 0.97 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.715 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -35.86 157.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.767 0.794 . . . . 0.0 110.676 -178.671 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -132.73 -177.55 4.54 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -179.31 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.595 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.42 -45.75 8.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.708 -1.245 . . . . 0.0 109.261 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 31.1 ttt180 -175.08 -85.22 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.477 -0.764 . . . . 0.0 109.899 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.68 33.81 5.32 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.003 -1.061 . . . . 0.0 109.854 -179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.473 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.2 mtt -67.8 -8.82 39.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.223 -0.923 . . . . 0.0 109.152 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.473 ' HB2' ' O ' ' A' ' 12' ' ' MET . 23.7 m-85 62.38 58.68 1.68 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.11 -41.21 5.89 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.216 -0.928 . . . . 0.0 109.315 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -55.3 123.77 14.89 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.439 1.114 . . . . 0.0 109.017 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.97 -28.79 54.24 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.065 -179.721 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 p -139.22 158.95 43.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.191 -0.943 . . . . 0.0 109.545 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 61.39 -146.81 48.11 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.4 p -150.85 171.12 17.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.253 -1.145 . . . . 0.0 109.602 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 20.9 m -56.5 114.9 2.22 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.377 -0.827 . . . . 0.0 109.553 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.0 mtt180 -119.03 141.82 48.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.124 -0.985 . . . . 0.0 109.247 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 11.2 t 51.4 21.98 1.34 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.166 -0.958 . . . . 0.0 109.068 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.63 -10.77 58.65 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.715 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.1 mttp -106.66 152.57 23.59 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.13 -1.217 . . . . 0.0 109.665 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.454 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.7 OUTLIER -63.06 167.8 4.61 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.596 179.486 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.541 0 O-C-N 119.972 -1.705 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.284 0.564 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.4 mmtp -119.07 169.89 9.53 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.178 -0.951 . . . . 0.0 110.041 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.457 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -112.48 177.47 18.48 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.873 -1.691 . . . . 0.0 108.873 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.455 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.6 pttt -59.53 153.63 19.2 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 120.89 -1.359 . . . . 0.0 109.447 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.66 -32.47 4.51 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.54 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -67.19 67.44 0.07 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.351 -1.087 . . . . 0.0 109.356 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -20.8 136.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.768 0.794 . . . . 0.0 111.831 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.2 -178.28 3.63 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.789 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.71 31.55 1.19 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 0.0 109.79 -178.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.7 ttm180 81.19 -43.59 0.19 Allowed 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.981 -0.449 . . . . 0.0 110.262 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.411 HD11 ' HG2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -149.95 81.61 1.38 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.819 -1.176 . . . . 0.0 110.72 -179.47 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.445 ' HG3' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -128.78 -9.19 4.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.101 -1.0 . . . . 0.0 109.613 178.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 58.22 59.55 3.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.036 -1.04 . . . . 0.0 109.85 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.01 -25.64 7.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.921 . . . . 0.0 109.181 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.4 m -56.75 123.75 16.05 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.393 1.092 . . . . 0.0 109.706 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.01 -19.89 34.58 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.236 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.4 p -93.52 -133.47 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.49 -0.756 . . . . 0.0 109.262 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.92 -95.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -147.54 -171.61 3.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.229 -1.16 . . . . 0.0 109.594 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.9 m -62.56 142.58 57.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.71 134.5 45.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.165 -0.959 . . . . 0.0 108.982 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.6 p 47.93 22.72 0.4 Allowed 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.504 -0.748 . . . . 0.0 109.415 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.25 -32.25 6.62 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.764 -1.334 . . . . 0.0 109.764 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.4 mttt -93.67 148.5 22.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.244 -1.151 . . . . 0.0 109.743 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.455 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -60.68 178.37 0.23 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.087 -1.008 . . . . 0.0 109.138 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 120.003 -1.686 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -110.19 165.01 12.09 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.238 -0.914 . . . . 0.0 110.233 -179.643 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.45 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -105.49 164.96 14.02 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -51.53 151.43 3.16 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.073 -1.251 . . . . 0.0 110.012 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.89 4.76 22.14 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.89 17.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.957 -1.32 . . . . 0.0 110.618 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.44 149.06 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.191 -0.943 . . . . 0.0 111.15 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -155.98 176.5 12.56 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.791 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.17 -53.7 4.13 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.033 -1.042 . . . . 0.0 108.712 179.365 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.516 ' CB ' ' O ' ' A' ' 9' ' ' SER . 7.6 ptt180 161.14 94.08 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 66.63 55.15 0.8 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.55 -0.719 . . . . 0.0 109.327 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.455 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -99.14 -9.48 23.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.438 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.455 ' HB2' ' O ' ' A' ' 12' ' ' MET . 14.2 m-85 69.02 31.56 4.08 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.17 -0.956 . . . . 0.0 109.607 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -97.9 -35.89 10.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.356 -0.84 . . . . 0.0 108.949 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -54.89 123.49 13.61 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 122.475 1.131 . . . . 0.0 109.989 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.483 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -62.61 -13.15 28.23 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.524 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.431 ' O ' ' C ' ' A' ' 18' ' ' GLY . 13.3 t -144.85 155.02 43.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 109.912 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.431 ' C ' ' O ' ' A' ' 17' ' ' THR . . . 42.11 -145.96 0.72 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.7 p -133.15 -166.53 1.78 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -1.101 . . . . 0.0 109.375 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.3 m -70.91 129.42 39.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.218 -0.926 . . . . 0.0 109.544 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.456 ' NH1' ' CG ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -114.17 125.17 53.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.284 -0.885 . . . . 0.0 109.182 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.77 15.54 2.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.349 -0.844 . . . . 0.0 109.848 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.06 -34.78 5.23 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -93.68 165.84 12.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -1.188 . . . . 0.0 109.622 -179.681 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.55 170.22 4.19 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.151 -0.968 . . . . 0.0 109.649 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.32 0 O-C-N 119.878 -1.764 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.44 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 7.9 p . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.537 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -146.62 167.29 24.13 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.263 -0.898 . . . . 0.0 110.485 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.21 -172.15 28.54 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 108.599 -1.8 . . . . 0.0 108.599 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.1 160.07 6.63 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.858 -1.377 . . . . 0.0 109.312 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.41 -13.99 48.3 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.564 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -73.26 60.83 0.61 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -1.09 . . . . 0.0 108.989 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.564 ' C ' ' O ' ' A' ' 6' ' ' ALA . 11.4 mtmt -18.36 131.67 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.836 0.827 . . . . 0.0 111.803 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.579 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.85 -179.2 3.94 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -179.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.579 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.4 -58.52 2.41 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.875 -1.141 . . . . 0.0 108.778 179.562 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.558 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 10.2 ptm180 177.05 24.91 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.77 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.558 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 160.98 -18.35 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.05 -1.031 . . . . 0.0 110.624 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.464 ' C ' ' O ' ' A' ' 11' ' ' LEU . 1.1 mmt -39.03 -29.87 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.434 -0.791 . . . . 0.0 109.748 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.479 ' N ' ' O ' ' A' ' 11' ' ' LEU . 3.3 m-85 64.41 62.49 0.81 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.376 -0.828 . . . . 0.0 110.34 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -99.38 -15.16 18.87 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.089 -1.007 . . . . 0.0 108.992 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.8 m -64.7 125.04 23.51 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 122.252 1.025 . . . . 0.0 108.798 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -50.7 -52.73 37.38 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.195 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 t -135.61 59.31 1.72 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.001 -1.062 . . . . 0.0 109.642 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.67 -173.11 41.1 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.5 m -125.52 -169.13 1.94 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -1.185 . . . . 0.0 109.556 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.2 m -86.79 111.23 20.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.622 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -114.59 129.37 56.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.143 -0.973 . . . . 0.0 109.119 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.69 9.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.083 -1.01 . . . . 0.0 109.103 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.92 -9.22 69.82 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mttt -109.81 146.24 35.37 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.366 -1.079 . . . . 0.0 109.697 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.08 166.84 0.48 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.253 -0.904 . . . . 0.0 109.145 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.59 0 O-C-N 120.045 -1.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.7 p . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.141 0.496 . . . . 0.0 109.662 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.476 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 12.0 mmtm -116.08 163.07 16.48 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.328 -0.858 . . . . 0.0 110.187 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.26 167.06 22.35 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.476 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -61.05 159.54 11.49 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.134 -1.215 . . . . 0.0 110.172 -179.436 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.3 -0.64 15.92 Favored Glycine 0 N--CA 1.494 2.519 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.91 18.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.837 -1.39 . . . . 0.0 111.024 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.27 146.92 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.015 0.912 . . . . 0.0 111.076 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.566 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.6 p 172.48 178.11 0.08 Allowed 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.909 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.506 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 40.4 t -93.6 151.55 19.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.195 -0.941 . . . . 0.0 109.201 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 9' ' ' SER . 6.0 mtm180 -39.64 -37.88 0.56 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.47 ' O ' ' C ' ' A' ' 12' ' ' MET . 2.6 mp -85.88 -111.34 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.47 ' C ' ' O ' ' A' ' 11' ' ' LEU . 33.3 mtt 39.5 75.33 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.191 -0.943 . . . . 0.0 109.636 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -72.56 50.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.164 -0.96 . . . . 0.0 109.711 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.4 ' O ' ' C ' ' A' ' 15' ' ' CYS . 72.1 m-20 -95.02 -29.75 14.45 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.453 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 40.1 m -44.42 126.19 5.16 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 122.217 1.008 . . . . 0.0 109.667 179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -64.91 -6.17 7.76 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.666 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 p -138.65 25.54 2.59 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.762 -1.211 . . . . 0.0 110.742 -179.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.453 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . 145.45 -122.61 1.73 Allowed Glycine 0 N--CA 1.492 2.423 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.09 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 14.3 t -147.37 -163.71 1.83 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.335 -1.097 . . . . 0.0 109.321 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.534 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -78.29 132.85 37.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.18 -0.95 . . . . 0.0 111.381 -179.767 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.538 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.1 ttm180 -119.29 114.37 22.28 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 2.0 t 79.52 -23.7 0.23 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.705 -0.622 . . . . 0.0 110.365 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.439 ' C ' ' SG ' ' A' ' 20' ' ' CYS . . . 150.22 -14.29 0.97 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 110.037 -1.225 . . . . 0.0 110.037 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 45.9 mttt -128.46 156.64 42.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.905 -1.35 . . . . 0.0 110.494 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.566 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m -53.85 169.39 0.16 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 120.064 -0.654 . . . . 0.0 109.817 -179.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 120.101 -1.625 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 37.6 mmtt -125.18 172.5 9.47 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.208 -0.932 . . . . 0.0 110.402 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.91 172.74 14.37 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.1 pttm -58.78 155.62 12.59 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 120.885 -1.362 . . . . 0.0 109.516 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.51 -30.67 7.08 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.495 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.11 75.46 3.68 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.653 -0.91 . . . . 0.0 108.699 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.67 150.23 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.528 0.68 . . . . 0.0 110.48 -179.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -128.66 -178.15 4.48 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.368 -0.832 . . . . 0.0 109.124 -179.531 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.527 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.0 35.39 0.98 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.218 -0.926 . . . . 0.0 109.848 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 55.33 93.17 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.151 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.273 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.31 62.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.516 0.674 . . . . 0.0 109.717 -179.609 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.473 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 2.6 mtp -117.9 -21.16 8.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.351 -0.843 . . . . 0.0 108.971 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.432 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.4 m-30 60.73 48.04 7.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 109.645 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.473 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 30.9 m-20 -111.46 -31.18 7.11 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.232 -0.917 . . . . 0.0 109.51 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.0 m -50.72 122.39 7.22 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 122.311 1.053 . . . . 0.0 108.923 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.55 -26.89 9.41 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.356 -179.463 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -132.52 113.24 12.86 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.232 -0.918 . . . . 0.0 109.805 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 -140.13 17.2 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.6 p -140.92 -169.46 2.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -1.108 . . . . 0.0 109.248 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 m -60.43 153.43 23.06 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.167 -0.958 . . . . 0.0 109.358 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -122.72 108.74 13.4 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.358 -0.839 . . . . 0.0 109.161 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 44.46 26.08 0.16 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.694 -0.629 . . . . 0.0 109.395 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.436 ' HA3' ' NH2' ' A' ' 10' ' ' ARG . . . 111.5 -27.69 10.33 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.89 -1.284 . . . . 0.0 109.89 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.0 mttt -102.79 135.15 44.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.208 -1.172 . . . . 0.0 109.837 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.461 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -56.52 174.57 0.14 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.211 -0.93 . . . . 0.0 108.777 179.614 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.39 0 O-C-N 119.805 -1.809 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 121.241 0.543 . . . . 0.0 109.555 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 3.5 mmmt -113.57 169.75 8.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.312 -0.868 . . . . 0.0 109.744 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -106.79 172.35 18.15 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.538 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.0 OUTLIER -62.09 147.51 47.18 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.149 -1.207 . . . . 0.0 108.775 179.57 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.538 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 63.73 6.36 16.89 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.54 19.26 0.64 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.004 -1.291 . . . . 0.0 110.816 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.55 149.46 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.167 -0.958 . . . . 0.0 111.427 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.612 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -152.64 -178.05 6.62 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.612 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.14 -69.36 0.73 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 120.699 -1.251 . . . . 0.0 108.279 179.322 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.505 ' HB3' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 166.19 108.32 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.68 44.95 0.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.515 -0.741 . . . . 0.0 109.58 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.442 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 23.3 mmt -109.95 -23.3 11.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.314 -0.866 . . . . 0.0 109.236 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 62.74 52.34 2.81 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.367 -0.833 . . . . 0.0 109.796 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -101.99 -21.15 14.55 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.241 -0.912 . . . . 0.0 109.086 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.1 m -63.14 123.06 17.66 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 122.589 1.185 . . . . 0.0 109.811 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.04 -22.01 2.13 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.281 179.547 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.44 144.7 34.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.49 -0.756 . . . . 0.0 109.324 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.33 -146.93 45.68 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.5 m -144.46 -163.92 1.79 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.128 -1.219 . . . . 0.0 109.67 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 m -74.88 153.29 38.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.16 -0.962 . . . . 0.0 109.774 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 24' ' ' LYS . 5.1 ttt180 -145.77 116.08 7.51 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.434 ' HB2' ' CE ' ' A' ' 24' ' ' LYS . 34.8 m 61.42 15.54 6.7 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.457 -0.777 . . . . 0.0 109.565 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 103.01 -6.24 51.13 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.6 OUTLIER -110.7 161.67 15.52 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.284 -1.127 . . . . 0.0 109.64 -179.869 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.82 174.36 8.58 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.212 -0.93 . . . . 0.0 109.619 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 119.91 -1.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.1 p . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.335 0.588 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 25.4 mmtp -111.77 168.29 9.69 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.495 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -114.29 167.83 12.42 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.474 ' HE3' HG22 ' A' ' 17' ' ' THR . 0.8 OUTLIER -46.91 165.44 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.306 -1.114 . . . . 0.0 110.074 -179.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.506 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 54.52 18.27 10.12 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.14 -1.584 . . . . 0.0 109.14 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -78.64 15.86 0.96 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.33 -1.1 . . . . 0.0 111.327 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.512 ' C ' ' O ' ' A' ' 6' ' ' ALA . 7.4 ptmm? 31.66 44.66 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 122.018 0.913 . . . . 0.0 109.68 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' N ' ' O ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -49.21 178.31 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 -178.917 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.555 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.25 36.4 0.99 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.042 -1.036 . . . . 0.0 109.57 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.52 ' CG ' HD22 ' A' ' 11' ' ' LEU . 2.0 ttp180 79.02 -80.94 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.978 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.52 HD22 ' CG ' ' A' ' 10' ' ' ARG . 2.0 mm? -115.53 79.62 1.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.001 -1.062 . . . . 0.0 109.487 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.449 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 2.8 mtt -122.53 -9.26 8.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 109.487 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 58.48 59.77 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.248 -0.907 . . . . 0.0 109.684 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -122.12 -21.21 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.679 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 19' ' ' SER . 57.5 m -58.32 119.63 7.27 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 122.483 1.135 . . . . 0.0 110.167 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.35 -18.4 4.05 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.707 179.402 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.474 HG22 ' HE3' ' A' ' 4' ' ' LYS . 2.4 t -114.98 -121.28 0.3 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.942 . . . . 0.0 109.833 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.461 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -61.2 -131.37 0.01 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.446 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.8 t -115.05 -149.36 0.44 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -1.182 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 25.9 m -96.7 137.19 36.15 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 109.803 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' A' ' 24' ' ' LYS . 1.4 ttp180 -107.08 117.02 32.97 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 50.11 23.04 1.04 Allowed 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.324 -0.86 . . . . 0.0 108.993 -179.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.597 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.76 -28.63 14.58 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.339 -1.505 . . . . 0.0 109.339 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.506 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 4.0 mttm -92.34 134.25 35.09 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.9 -1.353 . . . . 0.0 109.0 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 1.7 m -55.2 178.38 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.946 0 O-C-N 121.736 -0.603 . . . . 0.0 109.687 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.452 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.303 -1.428 0 O-C-N 120.01 -1.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.357 0.599 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.7 mmtt -126.9 172.93 10.0 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.261 -0.899 . . . . 0.0 110.443 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -113.78 -175.5 19.05 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 108.712 -1.755 . . . . 0.0 108.712 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.535 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.3 OUTLIER -62.59 145.18 55.08 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.775 -1.426 . . . . 0.0 108.108 179.411 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.535 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 106.22 -32.26 7.52 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 108.147 -1.981 . . . . 0.0 108.147 -178.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -72.24 76.14 0.99 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.5 153.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.463 0.649 . . . . 0.0 110.691 -179.263 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.578 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -137.14 -175.12 3.94 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.578 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.2 t -90.28 -44.11 9.93 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.457 -1.402 . . . . 0.0 109.771 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 9' ' ' SER . 3.0 ptm180 175.97 -34.76 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.82 0 O-C-N 121.332 -0.855 . . . . 0.0 109.981 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.81 23.4 0.77 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.2 mmt -60.27 -16.05 30.58 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.121 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 50.21 47.36 23.77 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.273 -0.892 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -94.67 -19.62 20.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 109.004 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 2.8 m -63.88 124.63 22.02 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.376 1.084 . . . . 0.0 108.522 179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -50.65 -52.27 41.3 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.829 -179.21 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.7 p -115.97 -61.81 1.68 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.091 -1.006 . . . . 0.0 110.216 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.527 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -62.37 -162.44 0.27 Allowed Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.95 173.66 11.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.395 -1.062 . . . . 0.0 108.863 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 m -58.62 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.04 -1.037 . . . . 0.0 109.363 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 24' ' ' LYS . 12.0 ttm180 -96.95 122.06 39.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.098 -1.001 . . . . 0.0 109.404 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 t 58.6 30.69 20.19 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.416 -0.803 . . . . 0.0 109.485 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.16 -10.5 63.24 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.5 mtmt -109.45 141.51 41.77 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.283 -1.128 . . . . 0.0 109.546 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -55.34 165.14 0.81 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 109.295 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.599 0 O-C-N 120.152 -1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.8 p . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -120.76 176.58 5.46 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.1 -1.0 . . . . 0.0 110.294 -179.595 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -116.15 167.92 12.58 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -60.75 153.29 24.64 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.022 -1.281 . . . . 0.0 109.514 -179.737 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.67 -0.24 2.33 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.19 26.59 0.44 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.641 -1.505 . . . . 0.0 110.711 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 55.52 159.7 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 O-C-N 120.932 -1.105 . . . . 0.0 110.506 -179.765 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -162.88 -179.17 6.59 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 6.2 m -90.95 -50.22 5.99 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.764 -1.21 . . . . 0.0 108.808 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.509 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 175.26 -76.9 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.775 -0.578 . . . . 0.0 109.689 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.05 31.48 6.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.116 -0.99 . . . . 0.0 109.607 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.424 ' O ' ' C ' ' A' ' 13' ' ' TYR . 1.7 mmm -74.93 -4.98 41.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.26 -0.9 . . . . 0.0 109.44 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.424 ' C ' ' O ' ' A' ' 12' ' ' MET . 6.3 m-85 43.31 54.11 5.25 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.257 -0.902 . . . . 0.0 109.575 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.431 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -95.5 -20.55 18.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.228 -0.92 . . . . 0.0 109.129 179.766 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.4 m -56.89 121.73 10.59 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.588 1.185 . . . . 0.0 109.511 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.29 -36.15 41.08 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.011 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.0 t -146.25 78.43 1.52 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.167 -0.958 . . . . 0.0 109.757 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 146.94 -170.94 27.78 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.691 -1.364 . . . . 0.0 109.691 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.0 OUTLIER -121.91 -162.29 0.98 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.258 -1.142 . . . . 0.0 109.074 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 38.9 m -97.5 149.4 22.22 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.872 -1.142 . . . . 0.0 110.144 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 24' ' ' LYS . 31.7 mtt180 -146.31 136.76 23.94 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 50.08 26.14 1.98 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.183 -0.948 . . . . 0.0 109.244 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.1 31.16 39.63 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.7 mtmt -145.33 157.81 43.96 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.295 -1.12 . . . . 0.0 110.067 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER -73.23 173.27 9.71 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.784 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.404 0 O-C-N 120.046 -1.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.7 p . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.352 0.596 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.517 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 1.9 mptt -94.58 160.22 14.73 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.39 -0.819 . . . . 0.0 109.586 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 25' ' ' CYS . . . -112.07 169.55 13.17 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HA ' ' CB ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -44.91 166.83 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.288 -1.125 . . . . 0.0 109.238 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.49 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 58.94 15.27 27.52 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.516 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.98 14.0 1.25 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.26 -1.141 . . . . 0.0 111.135 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER 30.19 45.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 121.703 0.764 . . . . 0.0 110.4 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -54.47 -178.68 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -179.558 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.597 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.6 -45.99 8.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.716 -1.24 . . . . 0.0 109.334 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 9' ' ' SER . 3.7 mtt180 178.63 -94.57 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.56 -0.713 . . . . 0.0 109.747 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -90.58 43.08 1.13 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.112 -0.993 . . . . 0.0 109.705 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.447 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 2.9 mmt -75.75 -19.04 59.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.237 -0.914 . . . . 0.0 109.389 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 49.07 41.82 19.99 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.17 -0.956 . . . . 0.0 109.667 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.47 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 58.8 m-20 -102.69 -20.57 14.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 65.1 m -50.1 117.18 2.19 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 122.326 1.06 . . . . 0.0 110.332 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -48.91 -27.65 3.24 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.419 179.203 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.501 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.1 t -98.88 -118.55 0.14 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.476 -0.765 . . . . 0.0 109.742 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.501 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -71.65 -114.09 0.05 OUTLIER Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 p -128.35 -168.12 1.86 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.333 -1.098 . . . . 0.0 109.735 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 38.3 m -69.32 150.6 47.18 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.339 -0.851 . . . . 0.0 109.991 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -128.54 123.59 33.87 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER 45.1 26.18 0.22 Allowed 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.576 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 99.97 -36.67 3.95 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.49 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 3.6 mtmm -92.01 141.27 28.8 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.224 -1.162 . . . . 0.0 109.104 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.532 ' CB ' ' HA ' ' A' ' 4' ' ' LYS . 1.7 m -56.74 176.02 0.11 Allowed 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.577 -0.702 . . . . 0.0 109.609 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.476 0 O-C-N 120.132 -1.605 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.3 p . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.295 0.569 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtp -116.84 174.38 6.12 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.19 -0.944 . . . . 0.0 110.004 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.432 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -118.71 177.71 16.5 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.403 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.4 mtpt -60.48 147.61 40.61 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.08 -1.247 . . . . 0.0 110.063 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.93 -14.7 51.79 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.98 64.09 2.41 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.435 -1.038 . . . . 0.0 109.25 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.561 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.5 OUTLIER -11.49 128.33 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.802 0.81 . . . . 0.0 112.168 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.589 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.02 -178.51 3.52 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -179.685 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.83 -66.28 0.94 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 120.98 -1.075 . . . . 0.0 108.601 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ptt180 168.82 108.9 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 7.2 mt 70.19 12.5 7.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.871 -0.518 . . . . 0.0 110.401 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.452 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 8.6 mtt -67.24 -29.61 69.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.097 -1.002 . . . . 0.0 109.117 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.452 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.5 m-85 64.74 65.95 0.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.798 . . . . 0.0 110.223 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -118.62 -19.1 8.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -0.85 . . . . 0.0 109.134 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.5 m -60.59 123.95 18.92 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.495 1.14 . . . . 0.0 109.673 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -55.84 -41.55 74.46 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.702 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.8 89.41 2.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 109.528 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.03 -168.61 22.89 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -128.61 -167.37 1.76 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.138 -1.213 . . . . 0.0 109.682 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 35.2 m -84.5 96.37 9.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.189 -0.945 . . . . 0.0 109.682 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' N ' ' O ' ' A' ' 24' ' ' LYS . 11.1 ptp180 -102.84 137.19 41.38 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.95 -1.094 . . . . 0.0 108.913 179.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.85 19.04 10.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.154 -0.966 . . . . 0.0 109.116 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.18 -9.12 74.02 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.476 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 28.4 mtmt -111.74 173.21 6.46 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.171 -1.194 . . . . 0.0 109.764 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.8 OUTLIER -73.62 164.55 26.5 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.334 179.746 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.583 0 O-C-N 120.081 -1.637 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.346 0.594 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 7.1 mmtm -131.08 169.11 16.32 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.183 -0.948 . . . . 0.0 110.437 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.84 166.46 14.8 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.5 pttm -50.21 154.85 1.09 Allowed 'General case' 0 C--N 1.306 -1.315 0 O-C-N 120.972 -1.31 . . . . 0.0 109.212 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.97 -20.31 36.94 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.533 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.91 68.74 4.03 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.376 -1.073 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.533 ' C ' ' O ' ' A' ' 6' ' ' ALA . 8.5 mttt -20.17 138.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.898 0.856 . . . . 0.0 112.38 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.605 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.39 -178.28 4.7 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 179.856 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.605 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 28.4 t -90.3 -73.35 0.53 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.737 -1.227 . . . . 0.0 108.13 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.582 ' CB ' ' CZ ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -167.82 17.88 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.536 -0.727 . . . . 0.0 110.459 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.568 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 157.7 36.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.418 -0.801 . . . . 0.0 109.494 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.414 ' O ' ' C ' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -82.54 8.68 11.08 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 109.518 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.454 ' CE1' HD23 ' A' ' 11' ' ' LEU . 8.0 m-85 44.28 49.51 7.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.532 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.493 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 6.0 p-10 -103.55 -35.3 8.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.211 -0.931 . . . . 0.0 109.534 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 4.0 m -61.11 125.14 22.65 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 122.349 1.071 . . . . 0.0 110.004 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -65.47 -33.19 75.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.884 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 1.3 t -117.94 -115.48 0.33 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -42.82 165.5 0.02 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.4 t -91.56 -174.46 3.89 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.308 -1.113 . . . . 0.0 109.555 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.2 m -61.18 105.18 0.46 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.324 -0.86 . . . . 0.0 109.46 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . 2.5 tmt_? -96.21 135.76 37.59 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.057 -1.027 . . . . 0.0 109.06 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.435 ' OG ' ' HD3' ' A' ' 21' ' ' ARG . 20.2 m 47.24 23.42 0.32 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.162 -0.961 . . . . 0.0 109.483 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.55 -20.26 49.35 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.596 -1.401 . . . . 0.0 109.596 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' A' ' 21' ' ' ARG . 4.8 mtmp? -101.72 148.5 25.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -1.146 . . . . 0.0 109.716 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.449 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.1 m -57.41 163.91 2.11 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.39 0 O-C-N 119.916 -1.74 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.4 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.261 0.553 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 28.5 mmtm -112.55 164.77 12.91 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -104.74 167.34 15.29 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.472 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 1.2 tttp -52.0 153.03 2.81 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.141 -1.211 . . . . 0.0 110.086 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.478 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 60.74 3.92 3.7 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.54 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.94 20.66 0.76 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.805 -1.409 . . . . 0.0 110.903 -179.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.54 ' O ' ' O ' ' A' ' 6' ' ' ALA . 13.4 mtpt 52.66 123.34 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 122.688 1.232 . . . . 0.0 111.379 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.08 -178.47 3.51 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.121 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.565 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -92.26 35.68 1.0 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.054 -1.029 . . . . 0.0 109.531 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 78.14 -54.83 0.5 Allowed 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.018 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.93 43.21 0.97 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.088 -1.007 . . . . 0.0 109.711 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.501 ' HB2' ' CB ' ' A' ' 9' ' ' SER . 0.1 OUTLIER -93.54 -3.89 52.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.0 109.555 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 55.89 55.86 6.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.249 -0.907 . . . . 0.0 109.766 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -102.89 -23.0 13.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.21 -0.931 . . . . 0.0 109.352 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.9 m -55.55 121.38 8.92 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 122.37 1.081 . . . . 0.0 109.629 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -48.07 -50.08 29.41 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.653 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.506 ' CG2' ' O ' ' A' ' 17' ' ' THR . 10.2 t -141.26 89.3 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.282 -0.886 . . . . 0.0 109.454 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.02 -173.42 28.07 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 m -121.35 -175.18 3.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -1.175 . . . . 0.0 109.5 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.0 m -93.43 131.53 38.54 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.257 -0.902 . . . . 0.0 109.747 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.2 ttp180 -119.6 119.78 34.77 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.322 -0.862 . . . . 0.0 109.235 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 59.03 15.38 3.97 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.352 -0.843 . . . . 0.0 109.577 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.04 -16.2 39.31 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.881 -1.287 . . . . 0.0 109.881 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.478 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 6.0 mtpt -94.98 154.57 17.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.232 -1.157 . . . . 0.0 109.468 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.21 178.87 2.62 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.037 -1.04 . . . . 0.0 109.494 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.472 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 119.92 -1.737 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.275 0.56 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 39.3 mmtt -119.05 -178.99 3.69 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.083 -1.011 . . . . 0.0 110.108 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.493 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -140.4 163.25 26.45 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.72 149.34 0.62 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.914 -1.344 . . . . 0.0 109.643 -179.727 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 92.35 -39.41 3.01 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.53 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.62 78.15 0.43 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.365 -1.079 . . . . 0.0 108.145 178.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.9 ptpp? -34.8 159.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.416 0.627 . . . . 0.0 110.265 -179.229 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.592 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -138.84 -175.07 4.02 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -179.61 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.592 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -89.79 -47.29 8.0 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.688 -1.257 . . . . 0.0 108.696 -179.764 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.556 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 173.44 -73.09 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.533 -0.73 . . . . 0.0 110.302 178.634 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.28 58.37 0.82 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.02 -1.05 . . . . 0.0 110.279 -179.272 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmt -101.36 -14.6 17.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.037 -1.039 . . . . 0.0 108.7 178.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 50.37 68.21 0.8 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.396 -0.815 . . . . 0.0 109.925 179.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.401 ' HB3' ' CG ' ' A' ' 2' ' ' LYS . 3.9 m-20 -115.35 -21.5 9.82 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 108.79 179.238 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -60.15 123.06 16.01 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.627 1.203 . . . . 0.0 109.188 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.75 -32.84 14.62 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.25 -179.681 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 p -138.62 122.08 17.24 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.907 . . . . 0.0 109.601 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.62 -156.83 26.02 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.6 t -138.5 -179.8 6.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.274 -1.133 . . . . 0.0 109.357 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.496 ' N ' ' OG ' ' A' ' 19' ' ' SER . 19.6 m -59.21 111.2 1.26 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.526 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 24' ' ' LYS . 15.3 tpt180 -103.77 127.52 51.24 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.995 -1.065 . . . . 0.0 109.134 179.345 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 69.59 14.83 8.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.328 -179.684 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.38 -16.76 59.49 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.7 mtpt -114.05 175.55 5.42 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.229 -1.16 . . . . 0.0 109.63 -179.884 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.486 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -73.32 170.2 15.54 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.083 -1.047 . . . . 0.0 108.61 179.656 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.514 0 O-C-N 120.072 -1.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.208 0.528 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtm -107.73 166.93 10.32 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.293 -0.879 . . . . 0.0 109.945 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.46 ' O ' ' HB1' ' A' ' 6' ' ' ALA . . . -102.89 -178.12 26.73 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.904 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -60.75 154.85 20.63 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.064 -1.256 . . . . 0.0 110.555 -179.585 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.403 ' HA2' ' HB2' ' A' ' 24' ' ' LYS . . . 45.91 18.47 0.26 Allowed Glycine 0 N--CA 1.494 2.526 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.14 25.88 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.951 -1.323 . . . . 0.0 110.607 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.2 mtmp? 55.25 150.79 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 122.126 0.965 . . . . 0.0 111.266 179.918 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -156.68 177.08 11.89 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.623 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.553 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -92.0 -44.97 8.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.089 -1.007 . . . . 0.0 108.392 179.196 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.469 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 3.3 ttp180 168.17 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.8 0 O-C-N 121.667 -0.645 . . . . 0.0 109.653 179.053 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.39 27.21 4.77 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.065 -1.022 . . . . 0.0 109.87 -179.878 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.5 -10.59 46.14 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.865 . . . . 0.0 109.787 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 55.84 59.77 3.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.203 -0.936 . . . . 0.0 109.402 -179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.46 -24.05 10.39 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.404 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.3 m -59.56 122.05 13.08 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 122.7 1.238 . . . . 0.0 110.056 -179.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -57.9 -20.29 35.99 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.743 179.673 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.9 t -154.57 123.62 6.33 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.7 175.31 50.68 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -169.62 1.67 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.294 -1.121 . . . . 0.0 109.599 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.7 m -75.25 146.48 41.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.152 -0.967 . . . . 0.0 109.446 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.459 ' O ' ' HB3' ' A' ' 22' ' ' SER . 0.0 OUTLIER -135.33 117.03 14.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.287 -0.883 . . . . 0.0 109.483 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 7.3 t 71.12 4.51 5.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.487 -0.758 . . . . 0.0 109.655 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.36 -1.36 28.03 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -123.37 176.3 6.22 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.348 -1.089 . . . . 0.0 109.191 179.841 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.44 176.22 7.0 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.416 -0.802 . . . . 0.0 109.684 179.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.36 0 O-C-N 119.88 -1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.294 0.568 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.6 mmmm -106.47 -156.9 0.59 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.357 -0.839 . . . . 0.0 109.661 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.47 ' O ' ' HB3' ' A' ' 6' ' ' ALA . . . -157.31 165.09 33.23 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.63 153.96 0.23 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 120.941 -1.329 . . . . 0.0 109.822 -179.687 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.468 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 86.92 -42.35 3.15 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.773 -1.731 . . . . 0.0 108.773 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -67.73 73.55 0.17 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.43 -1.041 . . . . 0.0 108.253 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.73 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -35.26 158.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.555 0.693 . . . . 0.0 110.478 -178.82 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.11 -177.8 4.46 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.806 -178.618 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.572 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -91.77 34.96 0.97 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.311 -0.868 . . . . 0.0 109.725 -179.246 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.572 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 87.89 -75.62 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.638 179.347 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.99 42.88 2.71 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.905 -1.122 . . . . 0.0 110.714 -178.897 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.442 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -83.15 -21.8 33.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.95 -1.094 . . . . 0.0 108.586 179.16 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 56.96 71.87 0.55 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.546 -0.721 . . . . 0.0 110.071 179.436 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.442 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 2.2 m-20 -122.95 -15.26 7.42 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.282 -0.886 . . . . 0.0 109.725 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.4 m -67.6 122.3 17.74 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.559 1.171 . . . . 0.0 109.73 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.73 -43.12 47.52 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.362 179.895 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 18' ' ' GLY . 6.6 p -88.66 -116.26 0.06 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.047 -1.033 . . . . 0.0 109.645 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.96 -144.56 0.01 OUTLIER Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -124.17 -148.89 0.41 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.162 -1.199 . . . . 0.0 109.445 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.3 m -79.52 110.8 15.18 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.335 -0.853 . . . . 0.0 109.518 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -102.45 138.22 39.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 109.113 179.536 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 t 47.71 27.58 1.09 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.223 -179.646 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.4 -17.01 41.22 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.73 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -102.49 157.67 16.76 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.254 -1.145 . . . . 0.0 109.482 -179.906 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -64.71 169.8 4.71 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 118.831 -1.148 . . . . 0.0 108.305 179.186 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.463 0 O-C-N 119.98 -1.7 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.452 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 11.8 p . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 8.8 mmtt -128.26 173.14 10.4 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.048 -1.032 . . . . 0.0 110.514 -179.204 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.83 162.46 12.36 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.476 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.482 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -55.18 156.08 4.37 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 120.943 -1.327 . . . . 0.0 109.32 -179.911 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.39 -28.19 10.4 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.24 75.96 3.79 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 121.544 -0.974 . . . . 0.0 108.711 179.328 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -29.79 146.35 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 121.554 0.692 . . . . 0.0 110.766 -179.607 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -126.76 -175.2 3.34 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -179.549 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.42 -52.34 4.96 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.802 -1.186 . . . . 0.0 108.994 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.538 ' CB ' ' O ' ' A' ' 9' ' ' SER . 31.5 ttm180 158.35 100.98 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 76.08 14.44 2.54 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.675 -0.641 . . . . 0.0 109.468 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.43 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mtp -61.23 -21.28 63.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.4 -0.812 . . . . 0.0 108.869 179.54 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD2' ' O ' ' A' ' 11' ' ' LEU . 53.8 m-85 60.3 68.63 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.313 -0.867 . . . . 0.0 109.891 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -127.18 -30.88 2.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.922 . . . . 0.0 109.606 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -50.53 124.62 11.1 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.01 -1.057 . . . . 0.0 109.036 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -58.22 -27.84 64.31 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.13 -179.713 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.43 ' CG2' ' O ' ' A' ' 17' ' ' THR . 5.3 t -131.47 92.97 3.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.657 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.76 -150.65 16.92 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.85 173.59 11.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.401 -1.058 . . . . 0.0 109.281 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.1 m -45.24 135.64 5.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.447 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.416 ' HG3' HH11 ' A' ' 21' ' ' ARG . 19.3 ttm-85 -115.94 118.59 33.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 109.377 179.787 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 44.88 25.35 0.15 Allowed 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.391 -0.818 . . . . 0.0 109.982 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.65 -43.02 1.8 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -92.78 152.14 19.63 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.078 -1.248 . . . . 0.0 110.416 -179.125 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.482 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -67.61 170.2 8.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.397 -0.814 . . . . 0.0 109.203 179.788 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.531 0 O-C-N 119.972 -1.705 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.238 0.542 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . 9.4 mmtp -115.57 178.42 4.31 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.231 -0.918 . . . . 0.0 110.336 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.458 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.54 169.82 17.47 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.579 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -40.1 149.88 0.06 Allowed 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.362 -1.081 . . . . 0.0 110.213 -179.767 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 89.28 -42.71 3.02 Favored Glycine 0 N--CA 1.487 2.055 0 N-CA-C 108.726 -1.75 . . . . 0.0 108.726 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.525 ' CB ' ' HB3' ' A' ' 2' ' ' LYS . . . -64.99 74.79 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.4 -1.059 . . . . 0.0 108.605 179.335 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.27 150.31 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.865 0.841 . . . . 0.0 111.116 -179.748 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -134.69 176.72 8.38 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.198 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.579 ' O ' ' C ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -92.49 112.99 25.14 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.692 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.579 ' C ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -13.6 88.39 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.267 0 CA-C-O 121.443 0.64 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.533 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 2.0 tt 79.59 106.3 0.07 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.682 -0.636 . . . . 0.0 109.789 -179.689 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.566 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -159.63 -35.34 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.503 -0.748 . . . . 0.0 109.452 179.626 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.566 ' CD2' ' O ' ' A' ' 12' ' ' MET . 13.5 m-85 86.51 44.59 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.802 -0.561 . . . . 0.0 110.352 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.448 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 1.1 m-20 -102.4 -36.06 8.57 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.697 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.1 m -58.11 124.96 21.14 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.455 1.121 . . . . 0.0 108.733 179.106 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.17 -27.43 63.82 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.669 -179.613 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -144.07 -81.45 0.18 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.219 -0.926 . . . . 0.0 110.046 -179.628 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.491 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -41.12 163.87 0.01 OUTLIER Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -179.486 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.54 171.32 7.43 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -1.156 . . . . 0.0 109.718 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.4 m -75.11 89.66 2.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.231 -0.918 . . . . 0.0 109.513 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -108.42 142.01 39.42 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.013 -1.054 . . . . 0.0 109.631 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.34 37.35 18.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.409 -0.807 . . . . 0.0 108.936 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.73 9.8 47.13 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -179.513 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 30.0 mtpt -117.99 141.06 48.86 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 121.292 -1.122 . . . . 0.0 110.342 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.513 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -56.13 171.21 0.27 Allowed 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.081 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.467 0 O-C-N 119.909 -1.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 15.7 mmtt -126.35 171.57 10.86 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.329 -0.857 . . . . 0.0 110.237 -179.744 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.49 176.12 16.02 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.027 -1.629 . . . . 0.0 109.027 179.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -55.47 150.21 12.24 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.001 -1.293 . . . . 0.0 109.687 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.53 -28.27 16.24 Favored Glycine 0 N--CA 1.487 2.042 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -179.27 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.525 ' CB ' ' HD2' ' A' ' 2' ' ' LYS . . . -69.48 73.57 0.36 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.679 -0.895 . . . . 0.0 108.671 179.214 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.84 150.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.188 0.518 . . . . 0.0 110.021 -179.768 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -163.58 -167.53 1.44 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.163 -0.961 . . . . 0.0 110.266 -179.44 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.53 -93.19 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.263 -0.898 . . . . 0.0 109.774 -179.532 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.8 OUTLIER -170.88 115.48 0.44 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.406 -0.809 . . . . 0.0 109.341 -179.748 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 80.37 13.99 0.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.624 -0.673 . . . . 0.0 109.346 -179.916 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.459 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -60.75 -21.79 63.37 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.31 -0.868 . . . . 0.0 109.212 179.84 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 3.6 m-85 63.9 52.28 2.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.432 -0.792 . . . . 0.0 110.261 179.448 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -121.65 -29.46 4.36 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.077 -1.015 . . . . 0.0 109.478 179.51 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 3.9 m -57.29 123.79 16.6 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.362 1.077 . . . . 0.0 109.382 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -56.33 -28.42 58.86 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.909 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.411 ' O ' HG21 ' A' ' 17' ' ' THR . 4.6 t -142.64 112.65 7.02 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.908 . . . . 0.0 109.372 -179.985 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.58 -144.41 15.82 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.1 p -151.39 176.68 11.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.186 -1.185 . . . . 0.0 109.778 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 7.9 m -88.7 103.47 15.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.383 -0.823 . . . . 0.0 109.322 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 22' ' ' SER . 44.2 mtp180 -116.64 143.26 45.84 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.303 -179.377 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 79.35 -36.26 0.17 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 109.926 -179.867 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.477 ' C ' ' HG3' ' A' ' 24' ' ' LYS . . . 143.77 -3.01 1.51 Allowed Glycine 0 N--CA 1.487 2.09 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 179.928 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mtmt -141.46 148.64 39.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.706 -1.467 . . . . 0.0 110.764 -179.658 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.559 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER -55.48 165.51 0.79 Allowed 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.762 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.478 0 O-C-N 120.03 -1.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.449 ' C ' ' HD2' ' A' ' 2' ' ' LYS . 17.5 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.334 0.588 . . . . 0.0 109.804 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.589 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 2.0 mptp? -105.13 178.42 4.57 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.422 -0.799 . . . . 0.0 109.915 -179.671 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.7 169.66 22.72 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 108.63 -1.788 . . . . 0.0 108.63 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 8.0 ptmt -53.07 154.33 3.07 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 120.914 -1.344 . . . . 0.0 109.038 -179.995 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.9 -26.87 12.53 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.898 -2.081 . . . . 0.0 107.898 -178.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.88 75.89 3.48 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.936 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -30.49 148.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.35 0.595 . . . . 0.0 110.243 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.585 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -164.67 -162.24 0.63 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.042 -1.036 . . . . 0.0 110.057 -179.648 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.512 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 1.0 OUTLIER -92.32 -141.14 0.2 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.853 -1.154 . . . . 0.0 109.22 -179.567 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -103.05 -64.2 1.1 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.032 -1.042 . . . . 0.0 109.99 -179.566 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.01 50.08 0.87 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.172 -0.955 . . . . 0.0 110.135 -179.573 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.512 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -80.13 -36.66 34.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.148 -0.97 . . . . 0.0 109.034 179.379 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' MET . 29.8 m-85 61.47 48.14 6.12 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.424 -0.798 . . . . 0.0 110.066 179.461 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.473 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -110.04 -11.1 14.66 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.178 -0.951 . . . . 0.0 109.04 179.387 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.9 m -69.07 122.53 18.92 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.339 1.066 . . . . 0.0 109.281 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -46.88 -54.78 9.24 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.988 -179.817 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 t -133.51 54.75 1.93 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.98 . . . . 0.0 109.454 -179.908 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -172.04 -158.06 15.32 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 179.938 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.6 m -143.03 170.07 16.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.173 -1.192 . . . . 0.0 109.683 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 9' ' ' SER . 64.1 m -93.5 85.32 4.89 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.479 -0.763 . . . . 0.0 108.998 179.767 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.528 ' O ' ' CB ' ' A' ' 22' ' ' SER . 31.8 ttp180 -100.25 134.04 43.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.616 -0.677 . . . . 0.0 109.558 -179.148 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER 79.56 -8.77 1.54 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.601 -0.687 . . . . 0.0 109.415 -179.517 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 116.69 -3.54 19.63 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.231 179.693 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.638 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -132.58 147.69 52.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.612 -1.523 . . . . 0.0 110.794 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.585 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -55.73 170.92 0.24 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.21 179.874 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.43 0 O-C-N 119.836 -1.79 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.288 0.566 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.505 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -120.77 166.9 13.1 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.139 -0.975 . . . . 0.0 110.086 -179.77 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.507 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -102.69 162.98 16.35 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -179.929 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.0 OUTLIER -54.31 161.81 1.25 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.211 -1.17 . . . . 0.0 109.85 -179.774 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.83 18.28 1.8 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.546 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.4 17.09 1.13 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.968 -1.313 . . . . 0.0 110.574 179.887 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.546 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER 52.68 129.26 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 122.53 1.157 . . . . 0.0 111.559 179.449 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.569 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.4 p -167.58 -168.69 1.06 Allowed 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.564 -0.71 . . . . 0.0 110.3 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 m -93.38 -129.95 0.13 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 109.553 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.542 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 16.6 tpt180 -137.77 109.67 7.18 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 120.807 -1.183 . . . . 0.0 109.419 -179.687 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.542 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 78.13 59.72 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.479 -0.763 . . . . 0.0 109.598 -179.993 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.4 mmm -118.28 -2.81 11.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 109.619 179.901 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 53.28 69.41 0.71 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.172 -0.955 . . . . 0.0 110.046 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.61 -29.86 1.32 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.327 -0.858 . . . . 0.0 109.772 179.559 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 5.6 m -60.42 121.12 11.3 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.452 1.12 . . . . 0.0 109.63 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.62 -35.57 21.55 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.108 -179.987 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.4 t -153.22 56.64 0.77 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.159 -0.963 . . . . 0.0 109.571 -179.898 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.25 -160.38 22.99 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.929 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.58 173.85 10.7 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.303 -1.116 . . . . 0.0 109.325 179.992 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 8.2 m -111.81 91.89 3.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.345 179.86 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.539 ' O ' ' CB ' ' A' ' 22' ' ' SER . 2.2 ttm180 -126.67 153.68 45.08 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.405 -0.809 . . . . 0.0 109.204 -179.458 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 78.69 -35.15 0.17 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.335 -0.853 . . . . 0.0 110.111 -179.961 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.31 -4.96 1.36 Allowed Glycine 0 N--CA 1.486 2.021 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.309 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HB3' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -146.65 162.74 37.82 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.594 -1.533 . . . . 0.0 110.431 -179.914 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.569 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -56.91 174.77 0.15 Allowed 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.002 -179.548 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.431 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.305 -1.347 0 O-C-N 119.979 -1.7 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.297 0.57 . . . . 0.0 109.676 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.2 mmtt -122.72 172.68 8.25 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.306 -0.871 . . . . 0.0 110.413 -179.261 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -127.67 163.75 21.29 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.743 -1.743 . . . . 0.0 108.743 179.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.45 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 4.4 pttt -49.77 154.88 0.94 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.885 -1.362 . . . . 0.0 109.071 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.401 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.05 -31.51 6.57 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.766 -2.134 . . . . 0.0 107.766 -178.724 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.71 74.45 0.42 Allowed 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.02 148.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.386 0.612 . . . . 0.0 110.58 -179.369 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.567 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.9 OUTLIER -170.08 -169.37 0.85 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.871 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 10.3 t -93.8 160.49 14.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.943 . . . . 0.0 109.927 -179.354 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.545 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 10.1 ttp180 -72.42 71.45 0.93 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.348 179.869 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.545 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 159.45 -16.24 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.732 -0.605 . . . . 0.0 110.238 179.801 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.466 ' C ' ' O ' ' A' ' 11' ' ' LEU . 4.0 mmm -38.48 -47.19 1.25 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.378 -0.826 . . . . 0.0 109.697 -179.772 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 58.86 26.24 14.61 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 109.531 179.734 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' CE ' ' A' ' 12' ' ' MET . 71.7 m-20 -95.26 -6.32 41.67 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.088 -1.007 . . . . 0.0 109.2 179.611 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.5 m -60.9 126.47 27.5 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.478 1.132 . . . . 0.0 109.089 179.608 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.28 -22.91 0.28 Allowed 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.403 -179.578 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -137.22 -85.88 0.31 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.942 -1.099 . . . . 0.0 110.052 179.867 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.479 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -57.23 -153.54 0.01 OUTLIER Glycine 0 N--CA 1.491 2.361 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.434 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 83.5 p -129.65 -166.04 1.61 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.317 -1.108 . . . . 0.0 109.812 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 21.4 m -98.3 93.79 6.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.257 -0.902 . . . . 0.0 109.773 -179.711 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 22' ' ' SER . 27.4 ttp180 -112.97 156.58 22.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.552 -0.717 . . . . 0.0 109.33 -179.431 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 31.4 t 63.22 10.68 4.79 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.243 -0.911 . . . . 0.0 109.338 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 94.58 -5.75 70.36 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.967 -1.111 . . . . 0.0 110.368 179.647 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.566 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -136.07 154.54 50.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.675 -1.485 . . . . 0.0 110.93 -179.249 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.567 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER -55.61 176.56 0.06 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.066 179.587 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.409 0 O-C-N 119.946 -1.722 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.305 0.574 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.3 mmtp -112.6 176.12 5.15 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.231 -0.918 . . . . 0.0 109.89 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.407 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -113.78 159.08 13.89 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.175 -1.57 . . . . 0.0 109.175 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.432 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.0 OUTLIER -52.47 159.0 1.09 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.24 -1.153 . . . . 0.0 110.075 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.95 15.74 1.06 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.675 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.07 23.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.786 -1.42 . . . . 0.0 110.702 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER 55.34 154.67 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.177 -0.952 . . . . 0.0 110.729 -179.759 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.8 p 163.45 -168.37 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.554 -0.716 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.432 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 1.5 t -92.35 -139.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.45 -0.781 . . . . 0.0 109.561 -179.243 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.576 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER -137.74 114.48 10.55 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.023 -1.048 . . . . 0.0 109.722 -179.455 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.576 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.92 6.67 0.28 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.087 0.47 . . . . 0.0 110.472 179.442 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.418 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -66.52 -30.1 70.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.99 -1.069 . . . . 0.0 108.364 178.962 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.418 ' HB2' ' O ' ' A' ' 12' ' ' MET . 1.1 m-85 65.35 66.25 0.54 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.536 -0.728 . . . . 0.0 110.166 179.535 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 4.8 p-10 -124.65 -1.3 7.98 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.875 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 4.0 m -81.99 124.74 30.04 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 122.448 1.118 . . . . 0.0 110.275 -179.978 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -50.5 -23.59 2.59 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.359 178.618 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 17' ' ' THR . 9.7 t -153.85 129.73 10.18 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.632 -0.667 . . . . 0.0 109.22 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.0 -145.44 17.72 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.5 m -144.48 -161.35 1.27 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -1.139 . . . . 0.0 109.216 179.984 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.471 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 1.3 m -119.71 85.9 2.46 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.139 -0.975 . . . . 0.0 110.129 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -117.97 -176.28 3.01 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.769 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 48.27 23.36 0.54 Allowed 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.115 -0.991 . . . . 0.0 109.267 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.3 6.96 76.89 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.465 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.0 mttt -146.49 160.53 41.98 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.871 -1.37 . . . . 0.0 110.705 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -54.62 -173.92 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.773 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.432 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.306 -1.292 0 O-C-N 119.865 -1.772 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.9 mmtp -137.69 176.21 8.9 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.072 -1.017 . . . . 0.0 110.491 -179.439 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -119.98 175.68 15.96 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.579 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -57.34 153.55 12.18 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.801 -1.411 . . . . 0.0 109.196 179.888 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.22 -29.95 10.84 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.928 -2.069 . . . . 0.0 107.928 -178.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.93 74.13 0.45 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.581 -0.952 . . . . 0.0 108.444 178.977 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.541 ' HA ' ' CB ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -32.51 152.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.407 0.622 . . . . 0.0 110.489 -179.442 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -169.76 -165.57 0.51 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.183 -0.948 . . . . 0.0 110.266 -179.614 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.416 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 39.7 m -92.76 -121.36 0.09 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.258 -0.901 . . . . 0.0 109.393 -179.424 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.517 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 12.8 mtm180 -143.23 115.48 8.45 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.678 -1.264 . . . . 0.0 109.415 -179.93 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.531 ' N ' HD23 ' A' ' 11' ' ' LEU . 1.3 mt 77.06 31.3 0.51 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.711 -0.618 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.48 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -78.92 -19.08 52.69 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.502 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.455 ' HB2' ' O ' ' A' ' 12' ' ' MET . 25.1 m-85 63.63 58.7 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.55 -0.719 . . . . 0.0 111.418 178.486 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.516 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -126.51 -14.81 5.73 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.945 -1.097 . . . . 0.0 109.717 179.095 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.2 m -73.51 129.37 37.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.296 1.045 . . . . 0.0 109.836 -179.943 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -60.87 -18.61 57.17 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.038 -179.743 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 18' ' ' GLY . 25.9 p -117.73 -111.56 0.34 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.113 -0.992 . . . . 0.0 109.257 -179.963 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -150.15 0.01 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 179.981 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.7 p -114.52 -165.98 1.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.345 -1.091 . . . . 0.0 109.65 -179.875 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 1.8 m -87.8 96.67 10.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.304 -0.872 . . . . 0.0 109.715 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -107.48 168.72 9.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.574 -0.704 . . . . 0.0 109.223 -179.679 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t 51.42 20.24 0.96 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.03 -1.044 . . . . 0.0 109.013 -179.52 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.466 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 78.35 2.77 84.79 Favored Glycine 0 N--CA 1.487 2.088 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.855 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.541 ' CB ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mttm -140.0 151.67 45.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.931 -1.335 . . . . 0.0 110.379 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -54.82 175.1 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 119.91 -0.716 . . . . 0.0 109.41 179.816 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.412 0 O-C-N 119.989 -1.694 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.1 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.511 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.6 mmmt -114.07 171.43 7.61 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.168 -0.958 . . . . 0.0 110.372 -179.36 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -119.3 149.13 18.12 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.51 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.3 OUTLIER -44.79 158.4 0.06 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.132 -1.216 . . . . 0.0 109.952 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.04 -2.75 24.76 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.569 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.02 23.26 0.47 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.923 -1.34 . . . . 0.0 111.054 -179.82 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.4 ptmm? 46.93 175.64 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.537 -0.727 . . . . 0.0 109.66 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.577 ' CB ' ' O ' ' A' ' 7' ' ' LYS . 3.7 p 150.8 -172.73 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 CA-C-O 121.394 0.616 . . . . 0.0 109.754 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 13.9 t -93.35 -132.42 0.15 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.854 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.498 ' HA ' ' O ' ' A' ' 20' ' ' CYS . 6.7 ptt180 -120.66 -24.65 5.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.732 -1.23 . . . . 0.0 109.861 179.999 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.446 HD13 ' CG ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -108.86 8.96 26.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.195 -0.941 . . . . 0.0 109.51 -179.968 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.456 ' SD ' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -46.26 -49.83 16.8 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.28 -0.888 . . . . 0.0 109.345 179.971 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 54.11 29.22 9.99 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 109.554 179.965 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.456 ' OD2' ' SD ' ' A' ' 12' ' ' MET . 29.6 m-20 -100.98 -4.66 27.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.359 -0.838 . . . . 0.0 109.479 179.858 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -64.68 124.24 21.4 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.331 1.062 . . . . 0.0 109.301 179.572 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.69 -49.75 18.93 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.954 -179.889 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.9 72.72 1.5 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.14 -0.975 . . . . 0.0 109.506 -179.916 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.58 -165.77 34.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.5 p -129.99 -175.29 3.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.194 179.889 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.498 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -108.82 114.0 27.41 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.309 -0.87 . . . . 0.0 110.019 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' A' ' 22' ' ' SER . 24.3 mtp180 -145.21 149.34 34.76 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.735 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 80.07 -12.01 1.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.483 -0.761 . . . . 0.0 109.792 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.469 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . 118.53 -3.93 15.3 Favored Glycine 0 N--CA 1.488 2.157 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.286 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mtmt -146.54 164.55 32.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.732 -1.452 . . . . 0.0 111.417 -179.881 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.533 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -61.65 174.99 0.68 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.771 -179.546 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.51 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.307 -1.271 0 O-C-N 119.935 -1.728 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.1 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.324 0.583 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.702 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 1.7 mmmm -122.34 168.24 12.31 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.343 -0.848 . . . . 0.0 110.344 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.24 151.42 17.18 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.521 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -46.18 153.05 0.35 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.156 -1.203 . . . . 0.0 110.252 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.88 -18.74 5.74 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.702 ' HB1' ' HE3' ' A' ' 2' ' ' LYS . . . -78.23 46.45 0.61 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.761 -1.435 . . . . 0.0 110.703 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 52.53 164.15 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.221 -0.924 . . . . 0.0 110.824 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 5.0 p -161.17 170.53 20.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.527 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 6.7 t -98.71 -86.86 0.35 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.254 -0.904 . . . . 0.0 108.967 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HD2' ' O ' ' A' ' 9' ' ' SER . 13.1 mmm180 -156.72 -38.89 0.08 Allowed 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.15 42.14 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.288 -0.883 . . . . 0.0 109.325 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.527 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 79.9 mtp -83.38 -15.37 50.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.295 -0.878 . . . . 0.0 109.529 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 12' ' ' MET . 12.9 m-85 74.9 49.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.446 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -99.32 -38.93 8.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.304 -0.873 . . . . 0.0 109.163 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 8.1 m -54.96 122.84 11.77 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 122.381 1.086 . . . . 0.0 109.658 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -63.12 -37.95 89.25 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.661 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.46 ' O ' ' O ' ' A' ' 18' ' ' GLY . 41.7 p -104.53 -99.69 0.32 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.299 -0.876 . . . . 0.0 109.465 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -143.25 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.5 t -148.07 -162.88 1.64 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.25 -1.147 . . . . 0.0 109.532 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -46.74 132.2 11.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 110.225 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -146.18 128.86 16.18 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.41 -0.806 . . . . 0.0 109.141 179.09 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ARG . 46.7 t 44.15 25.97 0.13 Allowed 'General case' 0 C--N 1.296 -1.734 0 O-C-N 121.463 -0.773 . . . . 0.0 109.863 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.463 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 96.36 -26.44 21.44 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.5 mptp? -103.26 165.4 11.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.312 -1.111 . . . . 0.0 109.321 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.521 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.441 0 O-C-N 121.169 -0.957 . . . . 0.0 109.908 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.5 p . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.679 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.733 ' NZ ' ' HB1' ' A' ' 6' ' ' ALA . 5.6 mmmt -109.13 -141.34 0.38 Allowed 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.3 -0.875 . . . . 0.0 109.678 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 25' ' ' CYS . . . -178.87 163.0 30.42 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.457 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -47.84 149.07 1.39 Allowed 'General case' 0 C--N 1.307 -1.269 0 O-C-N 120.896 -1.356 . . . . 0.0 109.275 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.74 -39.99 3.1 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 108.454 -1.859 . . . . 0.0 108.454 -179.148 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.733 ' HB1' ' NZ ' ' A' ' 2' ' ' LYS . . . -67.32 71.41 0.11 Allowed 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.425 -1.044 . . . . 0.0 108.495 179.184 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.633 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.92 153.13 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.763 0.792 . . . . 0.0 110.697 -179.211 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -131.94 -174.81 3.53 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -179.377 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 4.0 m -90.33 -46.84 8.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.659 -1.276 . . . . 0.0 108.701 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 9' ' ' SER . 1.9 mmm180 179.2 -87.55 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.614 -0.678 . . . . 0.0 109.746 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.95 21.32 7.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.046 -1.034 . . . . 0.0 109.827 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.46 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -56.35 -25.3 48.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.244 -0.91 . . . . 0.0 109.184 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 48.07 64.9 1.46 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.359 -0.838 . . . . 0.0 109.788 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.507 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 1.1 m-20 -119.82 -24.77 6.05 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.18 -0.95 . . . . 0.0 109.541 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 4.1 m -53.45 120.79 6.54 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.42 1.105 . . . . 0.0 109.443 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -47.03 -35.14 6.42 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.694 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 38.7 p -85.89 -137.07 0.07 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -52.99 -105.06 0.01 OUTLIER Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.1 p -151.08 -158.26 0.9 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.038 -1.272 . . . . 0.0 109.785 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 7.2 m -68.03 137.27 54.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.368 -0.833 . . . . 0.0 109.698 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -125.92 125.08 42.18 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.232 -0.918 . . . . 0.0 109.091 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.8 p 50.52 22.42 1.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.384 -0.823 . . . . 0.0 109.335 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.98 -19.76 53.0 Favored Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.633 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -100.47 140.96 33.98 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.378 -1.072 . . . . 0.0 109.409 179.881 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.498 ' HB3' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.02 -1.05 . . . . 0.0 108.916 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.253 0.549 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 20.6 mmtm -112.98 165.06 12.7 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.236 -0.915 . . . . 0.0 110.314 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.56 163.33 19.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -52.02 155.43 1.86 Allowed 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.175 -1.191 . . . . 0.0 110.152 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 59.62 8.24 7.13 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 18.34 0.88 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.852 -1.381 . . . . 0.0 110.587 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.04 154.13 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.189 -0.944 . . . . 0.0 110.713 -179.86 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -157.06 178.8 9.94 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.775 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 8.9 t -91.74 -45.43 8.43 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.831 -1.168 . . . . 0.0 108.646 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.434 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 176.91 -83.42 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.866 0 O-C-N 121.753 -0.592 . . . . 0.0 109.771 179.126 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.99 24.17 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.272 -0.893 . . . . 0.0 109.756 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 74.5 mmm -61.33 -16.53 46.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.051 -1.031 . . . . 0.0 109.256 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 58.25 60.96 2.45 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 0.0 109.572 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -106.81 -26.05 11.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.406 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -55.41 122.18 10.62 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 122.349 1.071 . . . . 0.0 109.562 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -53.68 -43.15 68.64 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.846 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.709 HG23 ' O ' ' A' ' 17' ' ' THR . 6.7 t -139.86 88.08 2.21 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 109.521 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.67 -162.53 26.61 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.3 p -132.7 -165.51 1.61 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.257 -1.143 . . . . 0.0 109.371 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 23.5 m -92.03 136.51 33.11 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.186 -0.946 . . . . 0.0 109.697 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -125.38 106.94 10.2 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.19 -0.944 . . . . 0.0 108.813 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.74 12.38 7.59 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 121.592 -0.693 . . . . 0.0 109.336 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 7' ' ' LYS . . . 112.26 -16.5 24.72 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.9 mtpt -94.19 145.8 24.45 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.615 -0.932 . . . . 0.0 109.356 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.489 0 O-C-N 121.113 -0.992 . . . . 0.0 109.454 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.421 0.629 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.457 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 10.1 mptt -97.67 167.42 10.97 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.329 -0.857 . . . . 0.0 109.785 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.19 170.69 17.13 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.341 -1.904 . . . . 0.0 108.341 179.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.445 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -49.38 147.27 3.34 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.738 -1.448 . . . . 0.0 108.896 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.23 -31.7 6.17 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.03 75.48 0.93 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.587 -0.949 . . . . 0.0 108.465 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.77 152.46 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.219 0.533 . . . . 0.0 110.58 -179.448 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.603 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.3 -177.6 4.79 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.603 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m -91.24 -62.5 1.43 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.791 -1.193 . . . . 0.0 109.074 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.497 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 166.01 102.4 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.497 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.18 15.64 1.37 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.599 -0.688 . . . . 0.0 109.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.439 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 3.9 mmm -69.71 -18.99 63.57 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.281 -0.887 . . . . 0.0 109.367 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.439 ' HB2' ' O ' ' A' ' 12' ' ' MET . 43.8 m-85 60.53 66.96 0.87 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.318 -0.864 . . . . 0.0 109.169 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -123.3 -22.44 5.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.356 -0.84 . . . . 0.0 109.767 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -64.27 119.93 11.22 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 122.483 1.135 . . . . 0.0 110.315 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.87 -38.37 55.79 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.42 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.48 102.71 4.53 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.389 -0.819 . . . . 0.0 109.397 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.99 -166.68 12.77 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.3 p -128.85 173.18 10.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.129 -1.219 . . . . 0.0 109.435 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.5 m -60.64 102.68 0.2 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.274 -0.891 . . . . 0.0 109.492 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.545 ' N ' ' O ' ' A' ' 24' ' ' LYS . 34.4 ttp180 -99.9 139.88 34.93 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.155 -0.965 . . . . 0.0 109.118 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 18.75 6.23 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.081 -1.012 . . . . 0.0 109.353 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.38 -11.9 70.81 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.9 mtpp -119.71 170.04 9.56 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.084 -1.245 . . . . 0.0 109.569 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.445 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m . . . . . 0 C--N 1.301 -1.503 0 O-C-N 121.187 -0.946 . . . . 0.0 109.472 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.7 p . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.402 0.62 . . . . 0.0 109.598 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.569 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 6.5 mmtp -119.33 -179.98 4.02 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.495 -0.753 . . . . 0.0 110.108 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -123.74 163.49 17.31 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -44.81 158.88 0.05 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.216 -1.167 . . . . 0.0 109.308 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 90.08 -34.57 4.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 108.869 -1.692 . . . . 0.0 108.869 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.467 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.5 72.57 0.99 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.381 -1.07 . . . . 0.0 108.449 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -35.52 156.18 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.179 0.514 . . . . 0.0 110.406 -179.159 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.26 -177.32 4.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.025 -1.047 . . . . 0.0 108.448 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.3 -62.51 1.42 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.898 -1.126 . . . . 0.0 109.256 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.52 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 167.9 96.94 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 O-C-N 121.564 -0.71 . . . . 0.0 109.923 179.418 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.84 54.56 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.579 -0.701 . . . . 0.0 109.547 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.402 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -108.31 -18.8 13.67 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' MET . 88.9 m-85 60.46 80.94 0.19 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 2' ' ' LYS . 3.6 m-20 -144.93 -37.8 0.28 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.248 -0.908 . . . . 0.0 109.347 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -60.37 126.13 26.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.42 1.105 . . . . 0.0 108.661 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -59.43 -36.51 76.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 46.5 p -108.1 135.91 48.66 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.057 -1.027 . . . . 0.0 109.513 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 51.12 -150.4 6.61 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.63 -164.13 1.45 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.393 -1.063 . . . . 0.0 109.469 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -61.28 107.72 0.81 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.465 -0.772 . . . . 0.0 109.854 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -97.17 137.99 35.36 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.004 -1.06 . . . . 0.0 109.05 179.313 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.6 20.77 1.14 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.363 -0.836 . . . . 0.0 109.275 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.7 -16.73 60.1 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 61.2 mttt -106.06 174.08 6.04 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.11 -1.229 . . . . 0.0 110.157 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 O-C-N 120.92 -1.112 . . . . 0.0 108.819 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.639 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 7.0 mmtt -134.04 168.48 18.73 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.123 -0.986 . . . . 0.0 110.377 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -100.79 170.05 21.63 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -60.8 159.81 10.5 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.157 -1.202 . . . . 0.0 109.918 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 60.22 8.39 8.77 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -80.37 15.96 1.45 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.914 -1.345 . . . . 0.0 110.412 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.89 153.85 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.862 0.839 . . . . 0.0 110.675 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.609 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -159.64 -177.94 6.74 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.41 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.609 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.2 -56.0 3.39 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 120.875 -1.141 . . . . 0.0 108.563 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CB ' ' O ' ' A' ' 9' ' ' SER . 1.1 ptm180 159.33 101.15 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 121.306 0.574 . . . . 0.0 109.655 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.55 51.96 0.46 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.679 -0.638 . . . . 0.0 109.799 179.668 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.503 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 1.9 mtp -106.28 -7.56 17.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.373 -0.83 . . . . 0.0 109.275 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 54.19 51.6 14.16 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.457 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.503 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 9.3 m-20 -104.62 -14.46 15.61 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.478 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.9 m -67.18 124.53 23.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 122.496 1.141 . . . . 0.0 109.706 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -59.84 -9.91 3.39 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.489 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.3 p -133.14 1.6 3.53 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.713 -1.242 . . . . 0.0 111.093 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -178.1 -145.2 5.86 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.159 -1.496 . . . . 0.0 110.41 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -119.74 -171.02 2.05 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.392 -1.064 . . . . 0.0 109.326 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -70.29 142.14 52.29 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 110.172 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.24 125.39 43.51 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 31.0 p 54.94 17.94 2.03 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.553 -0.717 . . . . 0.0 109.465 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.94 -45.71 1.28 Allowed Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.902 -1.279 . . . . 0.0 109.902 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.5 mttt -93.52 162.14 14.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.281 -1.129 . . . . 0.0 109.758 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.641 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 3.9 mmtm -127.29 174.73 8.72 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -120.04 168.49 13.74 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -48.49 154.45 0.64 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.882 -1.364 . . . . 0.0 109.515 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.78 -40.04 2.84 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.536 -2.226 . . . . 0.0 107.536 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.19 78.61 0.97 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.414 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.751 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -35.86 157.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.767 0.794 . . . . 0.0 110.676 -178.671 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -132.73 -177.55 4.54 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -179.31 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.595 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.42 -45.75 8.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.708 -1.245 . . . . 0.0 109.261 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 31.1 ttt180 -175.08 -85.22 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.477 -0.764 . . . . 0.0 109.899 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.461 HD23 ' CZ ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -122.68 33.81 5.32 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.003 -1.061 . . . . 0.0 109.854 -179.671 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.2 mtt -67.8 -8.82 39.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.223 -0.923 . . . . 0.0 109.152 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 12' ' ' MET . 23.7 m-85 62.38 58.68 1.68 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.11 -41.21 5.89 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.216 -0.928 . . . . 0.0 109.315 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -55.3 123.77 14.89 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.439 1.114 . . . . 0.0 109.017 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.97 -28.79 54.24 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.065 -179.721 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 p -139.22 158.95 43.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.191 -0.943 . . . . 0.0 109.545 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 61.39 -146.81 48.11 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.4 p -150.85 171.12 17.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.253 -1.145 . . . . 0.0 109.602 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 20.9 m -56.5 114.9 2.22 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.377 -0.827 . . . . 0.0 109.553 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.0 mtt180 -119.03 141.82 48.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.124 -0.985 . . . . 0.0 109.247 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 11.2 t 51.4 21.98 1.34 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.166 -0.958 . . . . 0.0 109.068 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.63 -10.77 58.65 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.751 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.1 mttp -106.66 152.57 23.59 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.13 -1.217 . . . . 0.0 109.665 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.471 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--N 1.301 -1.542 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.596 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.284 0.564 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.628 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 4.4 mmtp -119.07 169.89 9.53 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.178 -0.951 . . . . 0.0 110.041 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.48 177.47 18.48 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.873 -1.691 . . . . 0.0 108.873 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.6 pttt -59.53 153.63 19.2 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 120.89 -1.359 . . . . 0.0 109.447 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.66 -32.47 4.51 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -67.19 67.44 0.07 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.351 -1.087 . . . . 0.0 109.356 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -20.8 136.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.768 0.794 . . . . 0.0 111.831 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.2 -178.28 3.63 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.789 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.71 31.55 1.19 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 0.0 109.79 -178.898 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.7 ttm180 81.19 -43.59 0.19 Allowed 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.981 -0.449 . . . . 0.0 110.262 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -149.95 81.61 1.38 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.819 -1.176 . . . . 0.0 110.72 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.462 ' HG3' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -128.78 -9.19 4.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.101 -1.0 . . . . 0.0 109.613 178.947 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 58.22 59.55 3.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.036 -1.04 . . . . 0.0 109.85 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.01 -25.64 7.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.921 . . . . 0.0 109.181 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.4 m -56.75 123.75 16.05 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.393 1.092 . . . . 0.0 109.706 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.01 -19.89 34.58 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.236 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.4 p -93.52 -133.47 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.49 -0.756 . . . . 0.0 109.262 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.92 -95.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -147.54 -171.61 3.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.229 -1.16 . . . . 0.0 109.594 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.9 m -62.56 142.58 57.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.71 134.5 45.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.165 -0.959 . . . . 0.0 108.982 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.6 p 47.93 22.72 0.4 Allowed 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.504 -0.748 . . . . 0.0 109.415 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.25 -32.25 6.62 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.764 -1.334 . . . . 0.0 109.764 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.4 mttt -93.67 148.5 22.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.244 -1.151 . . . . 0.0 109.743 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.471 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.087 -1.008 . . . . 0.0 109.138 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -110.19 165.01 12.09 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.238 -0.914 . . . . 0.0 110.233 -179.643 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.448 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -105.49 164.96 14.02 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -51.53 151.43 3.16 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.073 -1.251 . . . . 0.0 110.012 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.89 4.76 22.14 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.89 17.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.957 -1.32 . . . . 0.0 110.618 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.44 149.06 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.191 -0.943 . . . . 0.0 111.15 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -155.98 176.5 12.56 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.791 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.17 -53.7 4.13 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.033 -1.042 . . . . 0.0 108.712 179.365 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.516 ' CB ' ' O ' ' A' ' 9' ' ' SER . 7.6 ptt180 161.14 94.08 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 66.63 55.15 0.8 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.55 -0.719 . . . . 0.0 109.327 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.434 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -99.14 -9.48 23.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.438 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 12' ' ' MET . 14.2 m-85 69.02 31.56 4.08 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.17 -0.956 . . . . 0.0 109.607 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -97.9 -35.89 10.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.356 -0.84 . . . . 0.0 108.949 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -54.89 123.49 13.61 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 122.475 1.131 . . . . 0.0 109.989 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -62.61 -13.15 28.23 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.524 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.431 ' O ' ' C ' ' A' ' 18' ' ' GLY . 13.3 t -144.85 155.02 43.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 109.912 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.431 ' C ' ' O ' ' A' ' 17' ' ' THR . . . 42.11 -145.96 0.72 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.7 p -133.15 -166.53 1.78 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -1.101 . . . . 0.0 109.375 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.3 m -70.91 129.42 39.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.218 -0.926 . . . . 0.0 109.544 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -114.17 125.17 53.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.284 -0.885 . . . . 0.0 109.182 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.77 15.54 2.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.349 -0.844 . . . . 0.0 109.848 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.06 -34.78 5.23 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -93.68 165.84 12.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -1.188 . . . . 0.0 109.622 -179.681 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.487 1.401 0 O-C-N 121.151 -0.968 . . . . 0.0 109.649 -179.853 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 7.9 p . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.573 ' HD2' ' HB2' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -146.62 167.29 24.13 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.263 -0.898 . . . . 0.0 110.485 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.21 -172.15 28.54 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 108.599 -1.8 . . . . 0.0 108.599 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.1 160.07 6.63 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.858 -1.377 . . . . 0.0 109.312 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.41 -13.99 48.3 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HB2' ' HD2' ' A' ' 2' ' ' LYS . . . -73.26 60.83 0.61 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -1.09 . . . . 0.0 108.989 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.564 ' C ' ' O ' ' A' ' 6' ' ' ALA . 11.4 mtmt -18.36 131.67 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.836 0.827 . . . . 0.0 111.803 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.579 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.85 -179.2 3.94 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -179.712 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.579 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.4 -58.52 2.41 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.875 -1.141 . . . . 0.0 108.778 179.562 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.676 ' O ' HD12 ' A' ' 11' ' ' LEU . 10.2 ptm180 177.05 24.91 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.77 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 160.98 -18.35 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.05 -1.031 . . . . 0.0 110.624 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.464 ' C ' ' O ' ' A' ' 11' ' ' LEU . 1.1 mmt -39.03 -29.87 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.434 -0.791 . . . . 0.0 109.748 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.479 ' N ' ' O ' ' A' ' 11' ' ' LEU . 3.3 m-85 64.41 62.49 0.81 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.376 -0.828 . . . . 0.0 110.34 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -99.38 -15.16 18.87 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.089 -1.007 . . . . 0.0 108.992 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.8 m -64.7 125.04 23.51 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 122.252 1.025 . . . . 0.0 108.798 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -50.7 -52.73 37.38 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.195 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 17' ' ' THR . 4.8 t -135.61 59.31 1.72 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.001 -1.062 . . . . 0.0 109.642 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.67 -173.11 41.1 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.5 m -125.52 -169.13 1.94 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -1.185 . . . . 0.0 109.556 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.2 m -86.79 111.23 20.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.622 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -114.59 129.37 56.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.143 -0.973 . . . . 0.0 109.119 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.69 9.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.083 -1.01 . . . . 0.0 109.103 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.92 -9.22 69.82 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mttt -109.81 146.24 35.37 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.366 -1.079 . . . . 0.0 109.697 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.302 -1.496 0 O-C-N 121.253 -0.904 . . . . 0.0 109.145 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.7 p . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.141 0.496 . . . . 0.0 109.662 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 12.0 mmtm -116.08 163.07 16.48 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.328 -0.858 . . . . 0.0 110.187 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.26 167.06 22.35 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -61.05 159.54 11.49 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.134 -1.215 . . . . 0.0 110.172 -179.436 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.3 -0.64 15.92 Favored Glycine 0 N--CA 1.494 2.519 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.91 18.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.837 -1.39 . . . . 0.0 111.024 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.27 146.92 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.015 0.912 . . . . 0.0 111.076 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.566 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.6 p 172.48 178.11 0.08 Allowed 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.909 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 40.4 t -93.6 151.55 19.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.195 -0.941 . . . . 0.0 109.201 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 9' ' ' SER . 6.0 mtm180 -39.64 -37.88 0.56 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.47 ' O ' ' C ' ' A' ' 12' ' ' MET . 2.6 mp -85.88 -111.34 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.47 ' C ' ' O ' ' A' ' 11' ' ' LEU . 33.3 mtt 39.5 75.33 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.191 -0.943 . . . . 0.0 109.636 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -72.56 50.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.164 -0.96 . . . . 0.0 109.711 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.4 ' O ' ' C ' ' A' ' 15' ' ' CYS . 72.1 m-20 -95.02 -29.75 14.45 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.469 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 40.1 m -44.42 126.19 5.16 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 122.217 1.008 . . . . 0.0 109.667 179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -64.91 -6.17 7.76 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.666 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 p -138.65 25.54 2.59 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.762 -1.211 . . . . 0.0 110.742 -179.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.469 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . 145.45 -122.61 1.73 Allowed Glycine 0 N--CA 1.492 2.423 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.09 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 14.3 t -147.37 -163.71 1.83 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.335 -1.097 . . . . 0.0 109.321 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.534 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -78.29 132.85 37.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.18 -0.95 . . . . 0.0 111.381 -179.767 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.538 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.1 ttm180 -119.29 114.37 22.28 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 2.0 t 79.52 -23.7 0.23 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.705 -0.622 . . . . 0.0 110.365 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.439 ' C ' ' SG ' ' A' ' 20' ' ' CYS . . . 150.22 -14.29 0.97 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 110.037 -1.225 . . . . 0.0 110.037 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 45.9 mttt -128.46 156.64 42.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.905 -1.35 . . . . 0.0 110.494 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.566 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m . . . . . 0 N--CA 1.49 1.55 0 C-N-CA 120.064 -0.654 . . . . 0.0 109.817 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 37.6 mmtt -125.18 172.5 9.47 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.208 -0.932 . . . . 0.0 110.402 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.91 172.74 14.37 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.477 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.1 pttm -58.78 155.62 12.59 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 120.885 -1.362 . . . . 0.0 109.516 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.51 -30.67 7.08 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.495 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.11 75.46 3.68 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.653 -0.91 . . . . 0.0 108.699 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.67 150.23 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.528 0.68 . . . . 0.0 110.48 -179.625 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -128.66 -178.15 4.48 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.368 -0.832 . . . . 0.0 109.124 -179.531 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.527 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.0 35.39 0.98 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.218 -0.926 . . . . 0.0 109.848 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 55.33 93.17 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.151 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.273 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.31 62.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.516 0.674 . . . . 0.0 109.717 -179.609 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.483 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 2.6 mtp -117.9 -21.16 8.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.351 -0.843 . . . . 0.0 108.971 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.4 m-30 60.73 48.04 7.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 109.645 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 30.9 m-20 -111.46 -31.18 7.11 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.232 -0.917 . . . . 0.0 109.51 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.0 m -50.72 122.39 7.22 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 122.311 1.053 . . . . 0.0 108.923 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.55 -26.89 9.41 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.356 -179.463 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -132.52 113.24 12.86 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.232 -0.918 . . . . 0.0 109.805 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 -140.13 17.2 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.6 p -140.92 -169.46 2.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -1.108 . . . . 0.0 109.248 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 m -60.43 153.43 23.06 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.167 -0.958 . . . . 0.0 109.358 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -122.72 108.74 13.4 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.358 -0.839 . . . . 0.0 109.161 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 44.46 26.08 0.16 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.694 -0.629 . . . . 0.0 109.395 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.463 ' HA3' ' NH2' ' A' ' 10' ' ' ARG . . . 111.5 -27.69 10.33 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.89 -1.284 . . . . 0.0 109.89 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.0 mttt -102.79 135.15 44.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.208 -1.172 . . . . 0.0 109.837 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.477 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.211 -0.93 . . . . 0.0 108.777 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 121.241 0.543 . . . . 0.0 109.555 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.684 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 3.5 mmmt -113.57 169.75 8.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.312 -0.868 . . . . 0.0 109.744 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.79 172.35 18.15 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.548 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.0 OUTLIER -62.09 147.51 47.18 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.149 -1.207 . . . . 0.0 108.775 179.57 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.548 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 63.73 6.36 16.89 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.684 ' HB1' ' HE3' ' A' ' 2' ' ' LYS . . . -79.54 19.26 0.64 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.004 -1.291 . . . . 0.0 110.816 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.55 149.46 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.167 -0.958 . . . . 0.0 111.427 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.612 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -152.64 -178.05 6.62 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.612 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.14 -69.36 0.73 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 120.699 -1.251 . . . . 0.0 108.279 179.322 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 166.19 108.32 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.68 44.95 0.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.515 -0.741 . . . . 0.0 109.58 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.485 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 23.3 mmt -109.95 -23.3 11.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.314 -0.866 . . . . 0.0 109.236 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 62.74 52.34 2.81 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.367 -0.833 . . . . 0.0 109.796 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -101.99 -21.15 14.55 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.241 -0.912 . . . . 0.0 109.086 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.1 m -63.14 123.06 17.66 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 122.589 1.185 . . . . 0.0 109.811 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.04 -22.01 2.13 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.281 179.547 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.44 144.7 34.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.49 -0.756 . . . . 0.0 109.324 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.33 -146.93 45.68 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.5 m -144.46 -163.92 1.79 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.128 -1.219 . . . . 0.0 109.67 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 m -74.88 153.29 38.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.16 -0.962 . . . . 0.0 109.774 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 24' ' ' LYS . 5.1 ttt180 -145.77 116.08 7.51 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.459 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.458 ' HB2' ' CE ' ' A' ' 24' ' ' LYS . 34.8 m 61.42 15.54 6.7 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.457 -0.777 . . . . 0.0 109.565 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 103.01 -6.24 51.13 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.6 OUTLIER -110.7 161.67 15.52 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.284 -1.127 . . . . 0.0 109.64 -179.869 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.212 -0.93 . . . . 0.0 109.619 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.1 p . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.335 0.588 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 25.4 mmtp -111.77 168.29 9.69 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.809 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -114.29 167.83 12.42 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.606 ' NZ ' HG21 ' A' ' 17' ' ' THR . 0.8 OUTLIER -46.91 165.44 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.306 -1.114 . . . . 0.0 110.074 -179.925 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 54.52 18.27 10.12 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.14 -1.584 . . . . 0.0 109.14 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.809 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -78.64 15.86 0.96 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.33 -1.1 . . . . 0.0 111.327 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.512 ' C ' ' O ' ' A' ' 6' ' ' ALA . 7.4 ptmm? 31.66 44.66 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 122.018 0.913 . . . . 0.0 109.68 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.597 ' N ' ' O ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -49.21 178.31 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 -178.917 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.555 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.25 36.4 0.99 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.042 -1.036 . . . . 0.0 109.57 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.638 ' HG2' HD23 ' A' ' 11' ' ' LEU . 2.0 ttp180 79.02 -80.94 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.978 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.638 HD23 ' HG2' ' A' ' 10' ' ' ARG . 2.0 mm? -115.53 79.62 1.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.001 -1.062 . . . . 0.0 109.487 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.463 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 2.8 mtt -122.53 -9.26 8.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 109.487 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 58.48 59.77 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.248 -0.907 . . . . 0.0 109.684 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -122.12 -21.21 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.679 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 19' ' ' SER . 57.5 m -58.32 119.63 7.27 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 122.483 1.135 . . . . 0.0 110.167 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.35 -18.4 4.05 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.707 179.402 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.606 HG21 ' NZ ' ' A' ' 4' ' ' LYS . 2.4 t -114.98 -121.28 0.3 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.942 . . . . 0.0 109.833 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.464 ' N ' HG23 ' A' ' 17' ' ' THR . . . -61.2 -131.37 0.01 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.446 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.8 t -115.05 -149.36 0.44 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -1.182 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 25.9 m -96.7 137.19 36.15 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 109.803 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 -107.08 117.02 32.97 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 50.11 23.04 1.04 Allowed 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.324 -0.86 . . . . 0.0 108.993 -179.208 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.597 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.76 -28.63 14.58 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.339 -1.505 . . . . 0.0 109.339 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 4.0 mttm -92.34 134.25 35.09 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.9 -1.353 . . . . 0.0 109.0 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 1.7 m . . . . . 0 C--N 1.291 -1.946 0 O-C-N 121.736 -0.603 . . . . 0.0 109.687 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.357 0.599 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.7 mmtt -126.9 172.93 10.0 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.261 -0.899 . . . . 0.0 110.443 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -113.78 -175.5 19.05 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 108.712 -1.755 . . . . 0.0 108.712 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.3 OUTLIER -62.59 145.18 55.08 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.775 -1.426 . . . . 0.0 108.108 179.411 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.539 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 106.22 -32.26 7.52 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 108.147 -1.981 . . . . 0.0 108.147 -178.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -72.24 76.14 0.99 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.5 153.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.463 0.649 . . . . 0.0 110.691 -179.263 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.578 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -137.14 -175.12 3.94 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.578 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.2 t -90.28 -44.11 9.93 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.457 -1.402 . . . . 0.0 109.771 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 9' ' ' SER . 3.0 ptm180 175.97 -34.76 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.82 0 O-C-N 121.332 -0.855 . . . . 0.0 109.981 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.81 23.4 0.77 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.2 mmt -60.27 -16.05 30.58 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.121 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 50.21 47.36 23.77 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.273 -0.892 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -94.67 -19.62 20.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 109.004 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 2.8 m -63.88 124.63 22.02 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.376 1.084 . . . . 0.0 108.522 179.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -50.65 -52.27 41.3 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.829 -179.21 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.7 p -115.97 -61.81 1.68 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.091 -1.006 . . . . 0.0 110.216 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.527 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -62.37 -162.44 0.27 Allowed Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.95 173.66 11.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.395 -1.062 . . . . 0.0 108.863 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 m -58.62 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.04 -1.037 . . . . 0.0 109.363 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 24' ' ' LYS . 12.0 ttm180 -96.95 122.06 39.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.098 -1.001 . . . . 0.0 109.404 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 t 58.6 30.69 20.19 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.416 -0.803 . . . . 0.0 109.485 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.16 -10.5 63.24 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.5 mtmt -109.45 141.51 41.77 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.283 -1.128 . . . . 0.0 109.546 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 109.295 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.8 p . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -120.76 176.58 5.46 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.1 -1.0 . . . . 0.0 110.294 -179.595 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -116.15 167.92 12.58 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.44 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -60.75 153.29 24.64 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.022 -1.281 . . . . 0.0 109.514 -179.737 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.409 ' HA2' ' HD2' ' A' ' 24' ' ' LYS . . . 62.67 -0.24 2.33 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.19 26.59 0.44 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.641 -1.505 . . . . 0.0 110.711 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 55.52 159.7 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 O-C-N 120.932 -1.105 . . . . 0.0 110.506 -179.765 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -162.88 -179.17 6.59 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 6.2 m -90.95 -50.22 5.99 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.764 -1.21 . . . . 0.0 108.808 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 175.26 -76.9 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.775 -0.578 . . . . 0.0 109.689 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.05 31.48 6.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.116 -0.99 . . . . 0.0 109.607 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.424 ' O ' ' C ' ' A' ' 13' ' ' TYR . 1.7 mmm -74.93 -4.98 41.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.26 -0.9 . . . . 0.0 109.44 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.424 ' C ' ' O ' ' A' ' 12' ' ' MET . 6.3 m-85 43.31 54.11 5.25 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.257 -0.902 . . . . 0.0 109.575 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.471 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -95.5 -20.55 18.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.228 -0.92 . . . . 0.0 109.129 179.766 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.4 m -56.89 121.73 10.59 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.588 1.185 . . . . 0.0 109.511 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.29 -36.15 41.08 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.011 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.524 HG23 ' O ' ' A' ' 17' ' ' THR . 3.0 t -146.25 78.43 1.52 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.167 -0.958 . . . . 0.0 109.757 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 146.94 -170.94 27.78 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.691 -1.364 . . . . 0.0 109.691 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.0 OUTLIER -121.91 -162.29 0.98 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.258 -1.142 . . . . 0.0 109.074 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 38.9 m -97.5 149.4 22.22 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.872 -1.142 . . . . 0.0 110.144 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 24' ' ' LYS . 31.7 mtt180 -146.31 136.76 23.94 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 50.08 26.14 1.98 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.183 -0.948 . . . . 0.0 109.244 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.1 31.16 39.63 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.7 mtmt -145.33 157.81 43.96 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.295 -1.12 . . . . 0.0 110.067 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.784 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.7 p . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.352 0.596 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.532 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 1.9 mptt -94.58 160.22 14.73 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.39 -0.819 . . . . 0.0 109.586 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.659 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -112.07 169.55 13.17 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.536 ' HA ' ' CB ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -44.91 166.83 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.288 -1.125 . . . . 0.0 109.238 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 58.94 15.27 27.52 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.659 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -77.98 14.0 1.25 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.26 -1.141 . . . . 0.0 111.135 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER 30.19 45.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 121.703 0.764 . . . . 0.0 110.4 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -54.47 -178.68 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -179.558 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.597 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.6 -45.99 8.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.716 -1.24 . . . . 0.0 109.334 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 9' ' ' SER . 3.7 mtt180 178.63 -94.57 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.56 -0.713 . . . . 0.0 109.747 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.409 ' HA ' HD22 ' A' ' 11' ' ' LEU . 2.8 mm? -90.58 43.08 1.13 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.112 -0.993 . . . . 0.0 109.705 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.447 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 2.9 mmt -75.75 -19.04 59.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.237 -0.914 . . . . 0.0 109.389 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 49.07 41.82 19.99 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.17 -0.956 . . . . 0.0 109.667 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.502 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 58.8 m-20 -102.69 -20.57 14.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 65.1 m -50.1 117.18 2.19 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 122.326 1.06 . . . . 0.0 110.332 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -48.91 -27.65 3.24 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.419 179.203 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.501 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.1 t -98.88 -118.55 0.14 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.476 -0.765 . . . . 0.0 109.742 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.501 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -71.65 -114.09 0.05 OUTLIER Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 p -128.35 -168.12 1.86 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.333 -1.098 . . . . 0.0 109.735 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 38.3 m -69.32 150.6 47.18 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.339 -0.851 . . . . 0.0 109.991 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -128.54 123.59 33.87 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER 45.1 26.18 0.22 Allowed 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.88 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.576 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 99.97 -36.67 3.95 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.485 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 3.6 mtmm -92.01 141.27 28.8 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.224 -1.162 . . . . 0.0 109.104 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.536 ' CB ' ' HA ' ' A' ' 4' ' ' LYS . 1.7 m . . . . . 0 C--N 1.298 -1.647 0 O-C-N 121.577 -0.702 . . . . 0.0 109.609 -179.474 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.3 p . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.295 0.569 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtp -116.84 174.38 6.12 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.19 -0.944 . . . . 0.0 110.004 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.432 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -118.71 177.71 16.5 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.4 mtpt -60.48 147.61 40.61 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.08 -1.247 . . . . 0.0 110.063 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.93 -14.7 51.79 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.98 64.09 2.41 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.435 -1.038 . . . . 0.0 109.25 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.561 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.5 OUTLIER -11.49 128.33 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.802 0.81 . . . . 0.0 112.168 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.589 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.02 -178.51 3.52 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -179.685 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.83 -66.28 0.94 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 120.98 -1.075 . . . . 0.0 108.601 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.543 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ptt180 168.82 108.9 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 7.2 mt 70.19 12.5 7.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.871 -0.518 . . . . 0.0 110.401 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.459 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 8.6 mtt -67.24 -29.61 69.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.097 -1.002 . . . . 0.0 109.117 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.5 m-85 64.74 65.95 0.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.798 . . . . 0.0 110.223 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -118.62 -19.1 8.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -0.85 . . . . 0.0 109.134 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.5 m -60.59 123.95 18.92 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.495 1.14 . . . . 0.0 109.673 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -55.84 -41.55 74.46 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.702 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.8 89.41 2.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 109.528 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.03 -168.61 22.89 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -128.61 -167.37 1.76 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.138 -1.213 . . . . 0.0 109.682 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 35.2 m -84.5 96.37 9.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.189 -0.945 . . . . 0.0 109.682 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' N ' ' O ' ' A' ' 24' ' ' LYS . 11.1 ptp180 -102.84 137.19 41.38 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.95 -1.094 . . . . 0.0 108.913 179.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.85 19.04 10.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.154 -0.966 . . . . 0.0 109.116 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.18 -9.12 74.02 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 28.4 mtmt -111.74 173.21 6.46 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.171 -1.194 . . . . 0.0 109.764 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.8 OUTLIER . . . . . 0 C--N 1.298 -1.639 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.334 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.346 0.594 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.535 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 7.1 mmtm -131.08 169.11 16.32 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.183 -0.948 . . . . 0.0 110.437 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.84 166.46 14.8 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.463 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.5 pttm -50.21 154.85 1.09 Allowed 'General case' 0 C--N 1.306 -1.315 0 O-C-N 120.972 -1.31 . . . . 0.0 109.212 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.97 -20.31 36.94 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.535 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -77.91 68.74 4.03 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.376 -1.073 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 8.5 mttt -20.17 138.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.898 0.856 . . . . 0.0 112.38 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.605 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.39 -178.28 4.7 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 179.856 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.605 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 28.4 t -90.3 -73.35 0.53 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.737 -1.227 . . . . 0.0 108.13 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.823 ' O ' HD12 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -167.82 17.88 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.536 -0.727 . . . . 0.0 110.459 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.823 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 157.7 36.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.418 -0.801 . . . . 0.0 109.494 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.414 ' O ' ' C ' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -82.54 8.68 11.08 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 109.518 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' HD23 ' A' ' 11' ' ' LEU . 8.0 m-85 44.28 49.51 7.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.532 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.497 ' O ' ' N ' ' A' ' 2' ' ' LYS . 6.0 p-10 -103.55 -35.3 8.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.211 -0.931 . . . . 0.0 109.534 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 4.0 m -61.11 125.14 22.65 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 122.349 1.071 . . . . 0.0 110.004 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -65.47 -33.19 75.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.884 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 1.3 t -117.94 -115.48 0.33 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -42.82 165.5 0.02 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.4 t -91.56 -174.46 3.89 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.308 -1.113 . . . . 0.0 109.555 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.2 m -61.18 105.18 0.46 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.324 -0.86 . . . . 0.0 109.46 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . 2.5 tmt_? -96.21 135.76 37.59 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.057 -1.027 . . . . 0.0 109.06 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.453 ' OG ' ' HD3' ' A' ' 21' ' ' ARG . 20.2 m 47.24 23.42 0.32 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.162 -0.961 . . . . 0.0 109.483 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.55 -20.26 49.35 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.596 -1.401 . . . . 0.0 109.596 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.8 mtmp? -101.72 148.5 25.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -1.146 . . . . 0.0 109.716 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.463 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.1 m . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.4 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.261 0.553 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 28.5 mmtm -112.55 164.77 12.91 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -104.74 167.34 15.29 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.415 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.2 tttp -52.0 153.03 2.81 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.141 -1.211 . . . . 0.0 110.086 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.5 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 60.74 3.92 3.7 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.54 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.94 20.66 0.76 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.805 -1.409 . . . . 0.0 110.903 -179.836 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.54 ' O ' ' O ' ' A' ' 6' ' ' ALA . 13.4 mtpt 52.66 123.34 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 122.688 1.232 . . . . 0.0 111.379 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.08 -178.47 3.51 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.121 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.565 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -92.26 35.68 1.0 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.054 -1.029 . . . . 0.0 109.531 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.503 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 78.14 -54.83 0.5 Allowed 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.018 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.93 43.21 0.97 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.088 -1.007 . . . . 0.0 109.711 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.549 ' HB2' ' HB2' ' A' ' 9' ' ' SER . 0.1 OUTLIER -93.54 -3.89 52.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.0 109.555 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 55.89 55.86 6.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.249 -0.907 . . . . 0.0 109.766 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -102.89 -23.0 13.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.21 -0.931 . . . . 0.0 109.352 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.9 m -55.55 121.38 8.92 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 122.37 1.081 . . . . 0.0 109.629 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -48.07 -50.08 29.41 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.653 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 17' ' ' THR . 10.2 t -141.26 89.3 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.282 -0.886 . . . . 0.0 109.454 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.02 -173.42 28.07 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 m -121.35 -175.18 3.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -1.175 . . . . 0.0 109.5 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.0 m -93.43 131.53 38.54 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.257 -0.902 . . . . 0.0 109.747 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 24' ' ' LYS . 39.2 ttp180 -119.6 119.78 34.77 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.322 -0.862 . . . . 0.0 109.235 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 59.03 15.38 3.97 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.352 -0.843 . . . . 0.0 109.577 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.04 -16.2 39.31 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.881 -1.287 . . . . 0.0 109.881 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 6.0 mtpt -94.98 154.57 17.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.232 -1.157 . . . . 0.0 109.468 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.415 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.037 -1.04 . . . . 0.0 109.494 -179.947 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.275 0.56 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 39.3 mmtt -119.05 -178.99 3.69 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.083 -1.011 . . . . 0.0 110.108 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -140.4 163.25 26.45 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.72 149.34 0.62 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.914 -1.344 . . . . 0.0 109.643 -179.727 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 92.35 -39.41 3.01 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.53 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.62 78.15 0.43 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.365 -1.079 . . . . 0.0 108.145 178.859 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.9 ptpp? -34.8 159.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.416 0.627 . . . . 0.0 110.265 -179.229 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.592 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -138.84 -175.07 4.02 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -179.61 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.592 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -89.79 -47.29 8.0 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.688 -1.257 . . . . 0.0 108.696 -179.764 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.551 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 173.44 -73.09 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.533 -0.73 . . . . 0.0 110.302 178.634 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.28 58.37 0.82 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.02 -1.05 . . . . 0.0 110.279 -179.272 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmt -101.36 -14.6 17.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.037 -1.039 . . . . 0.0 108.7 178.955 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 50.37 68.21 0.8 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.396 -0.815 . . . . 0.0 109.925 179.606 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB3' ' CG ' ' A' ' 2' ' ' LYS . 3.9 m-20 -115.35 -21.5 9.82 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 108.79 179.238 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -60.15 123.06 16.01 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.627 1.203 . . . . 0.0 109.188 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.75 -32.84 14.62 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.25 -179.681 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 p -138.62 122.08 17.24 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.907 . . . . 0.0 109.601 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.62 -156.83 26.02 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.6 t -138.5 -179.8 6.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.274 -1.133 . . . . 0.0 109.357 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.496 ' N ' ' OG ' ' A' ' 19' ' ' SER . 19.6 m -59.21 111.2 1.26 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.526 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 24' ' ' LYS . 15.3 tpt180 -103.77 127.52 51.24 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.995 -1.065 . . . . 0.0 109.134 179.345 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 69.59 14.83 8.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.328 -179.684 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.38 -16.76 59.49 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.7 mtpt -114.05 175.55 5.42 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.229 -1.16 . . . . 0.0 109.63 -179.884 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--N 1.303 -1.456 0 C-N-CA 119.083 -1.047 . . . . 0.0 108.61 179.656 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.208 0.528 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtm -107.73 166.93 10.32 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.293 -0.879 . . . . 0.0 109.945 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.89 -178.12 26.73 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -60.75 154.85 20.63 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.064 -1.256 . . . . 0.0 110.555 -179.585 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.419 ' HA2' ' HB2' ' A' ' 24' ' ' LYS . . . 45.91 18.47 0.26 Allowed Glycine 0 N--CA 1.494 2.526 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.14 25.88 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.951 -1.323 . . . . 0.0 110.607 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.2 mtmp? 55.25 150.79 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 122.126 0.965 . . . . 0.0 111.266 179.918 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -156.68 177.08 11.89 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.623 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.553 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -92.0 -44.97 8.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.089 -1.007 . . . . 0.0 108.392 179.196 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.469 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 3.3 ttp180 168.17 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.8 0 O-C-N 121.667 -0.645 . . . . 0.0 109.653 179.053 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 13' ' ' TYR . 0.4 OUTLIER -131.39 27.21 4.77 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.065 -1.022 . . . . 0.0 109.87 -179.878 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.5 -10.59 46.14 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.865 . . . . 0.0 109.787 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.648 ' CE1' HD23 ' A' ' 11' ' ' LEU . 12.5 m-30 55.84 59.77 3.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.203 -0.936 . . . . 0.0 109.402 -179.951 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.46 -24.05 10.39 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.404 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.3 m -59.56 122.05 13.08 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 122.7 1.238 . . . . 0.0 110.056 -179.844 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -57.9 -20.29 35.99 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.743 179.673 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 17' ' ' THR . 2.9 t -154.57 123.62 6.33 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.7 175.31 50.68 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 179.831 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -169.62 1.67 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.294 -1.121 . . . . 0.0 109.599 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.7 m -75.25 146.48 41.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.152 -0.967 . . . . 0.0 109.446 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -135.33 117.03 14.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.287 -0.883 . . . . 0.0 109.483 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 7.3 t 71.12 4.51 5.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.487 -0.758 . . . . 0.0 109.655 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.36 -1.36 28.03 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -123.37 176.3 6.22 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.348 -1.089 . . . . 0.0 109.191 179.841 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.3 -1.568 0 O-C-N 121.416 -0.802 . . . . 0.0 109.684 179.917 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.294 0.568 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.6 mmmm -106.47 -156.9 0.59 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.357 -0.839 . . . . 0.0 109.661 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -157.31 165.09 33.23 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.63 153.96 0.23 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 120.941 -1.329 . . . . 0.0 109.822 -179.687 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.468 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 86.92 -42.35 3.15 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.773 -1.731 . . . . 0.0 108.773 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -67.73 73.55 0.17 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.43 -1.041 . . . . 0.0 108.253 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -35.26 158.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.555 0.693 . . . . 0.0 110.478 -178.82 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.11 -177.8 4.46 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.806 -178.618 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.572 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -91.77 34.96 0.97 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.311 -0.868 . . . . 0.0 109.725 -179.246 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.572 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 87.89 -75.62 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.638 179.347 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.99 42.88 2.71 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.905 -1.122 . . . . 0.0 110.714 -178.897 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.454 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -83.15 -21.8 33.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.95 -1.094 . . . . 0.0 108.586 179.16 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 56.96 71.87 0.55 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.546 -0.721 . . . . 0.0 110.071 179.436 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 2.2 m-20 -122.95 -15.26 7.42 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.282 -0.886 . . . . 0.0 109.725 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.4 m -67.6 122.3 17.74 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.559 1.171 . . . . 0.0 109.73 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.73 -43.12 47.52 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.362 179.895 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 18' ' ' GLY . 6.6 p -88.66 -116.26 0.06 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.047 -1.033 . . . . 0.0 109.645 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.96 -144.56 0.01 OUTLIER Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -124.17 -148.89 0.41 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.162 -1.199 . . . . 0.0 109.445 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.3 m -79.52 110.8 15.18 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.335 -0.853 . . . . 0.0 109.518 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -102.45 138.22 39.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 109.113 179.536 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 t 47.71 27.58 1.09 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.223 -179.646 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.4 -17.01 41.22 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -102.49 157.67 16.76 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.254 -1.145 . . . . 0.0 109.482 -179.906 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.483 0 C-N-CA 118.831 -1.148 . . . . 0.0 108.305 179.186 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.451 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 11.8 p . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.512 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 8.8 mmtt -128.26 173.14 10.4 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.048 -1.032 . . . . 0.0 110.514 -179.204 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.83 162.46 12.36 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.476 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -55.18 156.08 4.37 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 120.943 -1.327 . . . . 0.0 109.32 -179.911 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.39 -28.19 10.4 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.271 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.24 75.96 3.79 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 121.544 -0.974 . . . . 0.0 108.711 179.328 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.666 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -29.79 146.35 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 121.554 0.692 . . . . 0.0 110.766 -179.607 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -126.76 -175.2 3.34 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -179.549 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.42 -52.34 4.96 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.802 -1.186 . . . . 0.0 108.994 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.538 ' CB ' ' O ' ' A' ' 9' ' ' SER . 31.5 ttm180 158.35 100.98 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 76.08 14.44 2.54 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.675 -0.641 . . . . 0.0 109.468 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mtp -61.23 -21.28 63.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.4 -0.812 . . . . 0.0 108.869 179.54 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD2' ' O ' ' A' ' 11' ' ' LEU . 53.8 m-85 60.3 68.63 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.313 -0.867 . . . . 0.0 109.891 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -127.18 -30.88 2.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.922 . . . . 0.0 109.606 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -50.53 124.62 11.1 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.01 -1.057 . . . . 0.0 109.036 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -58.22 -27.84 64.31 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.13 -179.713 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.693 HG23 ' O ' ' A' ' 17' ' ' THR . 5.3 t -131.47 92.97 3.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.657 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.76 -150.65 16.92 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.85 173.59 11.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.401 -1.058 . . . . 0.0 109.281 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.1 m -45.24 135.64 5.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.447 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.432 ' HG3' HH11 ' A' ' 21' ' ' ARG . 19.3 ttm-85 -115.94 118.59 33.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 109.377 179.787 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 44.88 25.35 0.15 Allowed 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.391 -0.818 . . . . 0.0 109.982 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.65 -43.02 1.8 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.666 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -92.78 152.14 19.63 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.078 -1.248 . . . . 0.0 110.416 -179.125 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.51 0 O-C-N 121.397 -0.814 . . . . 0.0 109.203 179.788 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.238 0.542 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 6' ' ' ALA . 9.4 mmtp -115.57 178.42 4.31 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.231 -0.918 . . . . 0.0 110.336 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.458 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.54 169.82 17.47 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.579 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -40.1 149.88 0.06 Allowed 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.362 -1.081 . . . . 0.0 110.213 -179.767 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 89.28 -42.71 3.02 Favored Glycine 0 N--CA 1.487 2.055 0 N-CA-C 108.726 -1.75 . . . . 0.0 108.726 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . . . -64.99 74.79 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.4 -1.059 . . . . 0.0 108.605 179.335 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.27 150.31 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.865 0.841 . . . . 0.0 111.116 -179.748 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -134.69 176.72 8.38 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.198 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.579 ' O ' ' C ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -92.49 112.99 25.14 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.692 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.579 ' C ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -13.6 88.39 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.267 0 CA-C-O 121.443 0.64 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.533 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 2.0 tt 79.59 106.3 0.07 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.682 -0.636 . . . . 0.0 109.789 -179.689 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.566 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -159.63 -35.34 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.503 -0.748 . . . . 0.0 109.452 179.626 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.566 ' CD2' ' O ' ' A' ' 12' ' ' MET . 13.5 m-85 86.51 44.59 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.802 -0.561 . . . . 0.0 110.352 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.458 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 1.1 m-20 -102.4 -36.06 8.57 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.697 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.1 m -58.11 124.96 21.14 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.455 1.121 . . . . 0.0 108.733 179.106 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.17 -27.43 63.82 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.669 -179.613 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -144.07 -81.45 0.18 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.219 -0.926 . . . . 0.0 110.046 -179.628 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -41.12 163.87 0.01 OUTLIER Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -179.486 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.54 171.32 7.43 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -1.156 . . . . 0.0 109.718 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.4 m -75.11 89.66 2.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.231 -0.918 . . . . 0.0 109.513 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -108.42 142.01 39.42 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.013 -1.054 . . . . 0.0 109.631 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.34 37.35 18.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.409 -0.807 . . . . 0.0 108.936 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.73 9.8 47.13 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -179.513 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 30.0 mtpt -117.99 141.06 48.86 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 121.292 -1.122 . . . . 0.0 110.342 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--N 1.302 -1.478 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.081 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 15.7 mmtt -126.35 171.57 10.86 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.329 -0.857 . . . . 0.0 110.237 -179.744 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.49 176.12 16.02 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.027 -1.629 . . . . 0.0 109.027 179.644 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -55.47 150.21 12.24 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.001 -1.293 . . . . 0.0 109.687 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.53 -28.27 16.24 Favored Glycine 0 N--CA 1.487 2.042 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -179.27 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.538 ' CB ' ' HD2' ' A' ' 2' ' ' LYS . . . -69.48 73.57 0.36 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.679 -0.895 . . . . 0.0 108.671 179.214 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.84 150.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.188 0.518 . . . . 0.0 110.021 -179.768 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -163.58 -167.53 1.44 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.163 -0.961 . . . . 0.0 110.266 -179.44 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.53 -93.19 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.263 -0.898 . . . . 0.0 109.774 -179.532 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.8 OUTLIER -170.88 115.48 0.44 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.406 -0.809 . . . . 0.0 109.341 -179.748 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 80.37 13.99 0.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.624 -0.673 . . . . 0.0 109.346 -179.916 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -60.75 -21.79 63.37 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.31 -0.868 . . . . 0.0 109.212 179.84 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 12' ' ' MET . 3.6 m-85 63.9 52.28 2.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.432 -0.792 . . . . 0.0 110.261 179.448 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -121.65 -29.46 4.36 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.077 -1.015 . . . . 0.0 109.478 179.51 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 3.9 m -57.29 123.79 16.6 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.362 1.077 . . . . 0.0 109.382 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -56.33 -28.42 58.86 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.909 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.569 HG23 ' O ' ' A' ' 17' ' ' THR . 4.6 t -142.64 112.65 7.02 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.908 . . . . 0.0 109.372 -179.985 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.58 -144.41 15.82 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.1 p -151.39 176.68 11.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.186 -1.185 . . . . 0.0 109.778 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 7.9 m -88.7 103.47 15.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.383 -0.823 . . . . 0.0 109.322 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 22' ' ' SER . 44.2 mtp180 -116.64 143.26 45.84 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.303 -179.377 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 79.35 -36.26 0.17 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 109.926 -179.867 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.489 ' C ' ' HG3' ' A' ' 24' ' ' LYS . . . 143.77 -3.01 1.51 Allowed Glycine 0 N--CA 1.487 2.09 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 179.928 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mtmt -141.46 148.64 39.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.706 -1.467 . . . . 0.0 110.764 -179.658 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.559 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.762 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.474 ' C ' ' HD2' ' A' ' 2' ' ' LYS . 17.5 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.334 0.588 . . . . 0.0 109.804 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.589 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 2.0 mptp? -105.13 178.42 4.57 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.422 -0.799 . . . . 0.0 109.915 -179.671 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.7 169.66 22.72 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 108.63 -1.788 . . . . 0.0 108.63 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.448 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 8.0 ptmt -53.07 154.33 3.07 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 120.914 -1.344 . . . . 0.0 109.038 -179.995 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.9 -26.87 12.53 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.898 -2.081 . . . . 0.0 107.898 -178.846 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.88 75.89 3.48 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.936 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -30.49 148.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.35 0.595 . . . . 0.0 110.243 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.585 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -164.67 -162.24 0.63 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.042 -1.036 . . . . 0.0 110.057 -179.648 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.512 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 1.0 OUTLIER -92.32 -141.14 0.2 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.853 -1.154 . . . . 0.0 109.22 -179.567 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -103.05 -64.2 1.1 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.032 -1.042 . . . . 0.0 109.99 -179.566 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.01 50.08 0.87 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.172 -0.955 . . . . 0.0 110.135 -179.573 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.512 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -80.13 -36.66 34.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.148 -0.97 . . . . 0.0 109.034 179.379 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 12' ' ' MET . 29.8 m-85 61.47 48.14 6.12 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.424 -0.798 . . . . 0.0 110.066 179.461 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.473 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -110.04 -11.1 14.66 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.178 -0.951 . . . . 0.0 109.04 179.387 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.9 m -69.07 122.53 18.92 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.339 1.066 . . . . 0.0 109.281 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -46.88 -54.78 9.24 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.988 -179.817 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 t -133.51 54.75 1.93 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.98 . . . . 0.0 109.454 -179.908 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -172.04 -158.06 15.32 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 179.938 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.6 m -143.03 170.07 16.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.173 -1.192 . . . . 0.0 109.683 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 9' ' ' SER . 64.1 m -93.5 85.32 4.89 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.479 -0.763 . . . . 0.0 108.998 179.767 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.528 ' O ' ' CB ' ' A' ' 22' ' ' SER . 31.8 ttp180 -100.25 134.04 43.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.616 -0.677 . . . . 0.0 109.558 -179.148 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER 79.56 -8.77 1.54 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.601 -0.687 . . . . 0.0 109.415 -179.517 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 116.69 -3.54 19.63 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.231 179.693 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -132.58 147.69 52.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.612 -1.523 . . . . 0.0 110.794 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.585 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.458 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.21 179.874 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.288 0.566 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -120.77 166.9 13.1 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.139 -0.975 . . . . 0.0 110.086 -179.77 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -102.69 162.98 16.35 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -179.929 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.431 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -54.31 161.81 1.25 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.211 -1.17 . . . . 0.0 109.85 -179.774 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.83 18.28 1.8 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -80.4 17.09 1.13 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.968 -1.313 . . . . 0.0 110.574 179.887 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.546 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER 52.68 129.26 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 122.53 1.157 . . . . 0.0 111.559 179.449 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.569 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.4 p -167.58 -168.69 1.06 Allowed 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.564 -0.71 . . . . 0.0 110.3 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 m -93.38 -129.95 0.13 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 109.553 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CZ ' ' HG3' ' A' ' 21' ' ' ARG . 16.6 tpt180 -137.77 109.67 7.18 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 120.807 -1.183 . . . . 0.0 109.419 -179.687 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.542 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 78.13 59.72 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.479 -0.763 . . . . 0.0 109.598 -179.993 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.4 mmm -118.28 -2.81 11.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 109.619 179.901 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 53.28 69.41 0.71 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.172 -0.955 . . . . 0.0 110.046 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.61 -29.86 1.32 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.327 -0.858 . . . . 0.0 109.772 179.559 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 5.6 m -60.42 121.12 11.3 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.452 1.12 . . . . 0.0 109.63 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.62 -35.57 21.55 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.108 -179.987 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.4 t -153.22 56.64 0.77 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.159 -0.963 . . . . 0.0 109.571 -179.898 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.25 -160.38 22.99 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.58 173.85 10.7 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.303 -1.116 . . . . 0.0 109.325 179.992 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 8.2 m -111.81 91.89 3.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.345 179.86 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.557 ' HG3' ' CZ ' ' A' ' 10' ' ' ARG . 2.2 ttm180 -126.67 153.68 45.08 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.405 -0.809 . . . . 0.0 109.204 -179.458 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 78.69 -35.15 0.17 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.335 -0.853 . . . . 0.0 110.111 -179.961 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.31 -4.96 1.36 Allowed Glycine 0 N--CA 1.486 2.021 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.309 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -146.65 162.74 37.82 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.594 -1.533 . . . . 0.0 110.431 -179.914 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.569 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.002 -179.548 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.297 0.57 . . . . 0.0 109.676 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.2 mmtt -122.72 172.68 8.25 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.306 -0.871 . . . . 0.0 110.413 -179.261 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -127.67 163.75 21.29 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.743 -1.743 . . . . 0.0 108.743 179.434 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.469 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 4.4 pttt -49.77 154.88 0.94 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.885 -1.362 . . . . 0.0 109.071 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.421 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.05 -31.51 6.57 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.766 -2.134 . . . . 0.0 107.766 -178.724 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.71 74.45 0.42 Allowed 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.02 148.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.386 0.612 . . . . 0.0 110.58 -179.369 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.567 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.9 OUTLIER -170.08 -169.37 0.85 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.871 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 10.3 t -93.8 160.49 14.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.943 . . . . 0.0 109.927 -179.354 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.624 ' O ' HD12 ' A' ' 11' ' ' LEU . 10.1 ttp180 -72.42 71.45 0.93 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.348 179.869 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 159.45 -16.24 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.732 -0.605 . . . . 0.0 110.238 179.801 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.466 ' C ' ' O ' ' A' ' 11' ' ' LEU . 4.0 mmm -38.48 -47.19 1.25 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.378 -0.826 . . . . 0.0 109.697 -179.772 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 58.86 26.24 14.61 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 109.531 179.734 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' CE ' ' A' ' 12' ' ' MET . 71.7 m-20 -95.26 -6.32 41.67 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.088 -1.007 . . . . 0.0 109.2 179.611 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.5 m -60.9 126.47 27.5 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.478 1.132 . . . . 0.0 109.089 179.608 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.28 -22.91 0.28 Allowed 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.403 -179.578 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -137.22 -85.88 0.31 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.942 -1.099 . . . . 0.0 110.052 179.867 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.487 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -57.23 -153.54 0.01 OUTLIER Glycine 0 N--CA 1.491 2.361 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.434 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 83.5 p -129.65 -166.04 1.61 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.317 -1.108 . . . . 0.0 109.812 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 21.4 m -98.3 93.79 6.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.257 -0.902 . . . . 0.0 109.773 -179.711 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' O ' ' HB3' ' A' ' 22' ' ' SER . 27.4 ttp180 -112.97 156.58 22.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.552 -0.717 . . . . 0.0 109.33 -179.431 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.441 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 31.4 t 63.22 10.68 4.79 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.243 -0.911 . . . . 0.0 109.338 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 94.58 -5.75 70.36 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.967 -1.111 . . . . 0.0 110.368 179.647 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -136.07 154.54 50.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.675 -1.485 . . . . 0.0 110.93 -179.249 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.567 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.066 179.587 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.305 0.574 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.3 mmtp -112.6 176.12 5.15 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.231 -0.918 . . . . 0.0 109.89 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.407 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -113.78 159.08 13.89 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.175 -1.57 . . . . 0.0 109.175 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -52.47 159.0 1.09 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.24 -1.153 . . . . 0.0 110.075 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.95 15.74 1.06 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.675 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.07 23.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.786 -1.42 . . . . 0.0 110.702 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER 55.34 154.67 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.177 -0.952 . . . . 0.0 110.729 -179.759 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.8 p 163.45 -168.37 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.554 -0.716 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.45 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 1.5 t -92.35 -139.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.45 -0.781 . . . . 0.0 109.561 -179.243 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.576 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER -137.74 114.48 10.55 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.023 -1.048 . . . . 0.0 109.722 -179.455 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.576 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.92 6.67 0.28 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.087 0.47 . . . . 0.0 110.472 179.442 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.427 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -66.52 -30.1 70.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.99 -1.069 . . . . 0.0 108.364 178.962 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 12' ' ' MET . 1.1 m-85 65.35 66.25 0.54 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.536 -0.728 . . . . 0.0 110.166 179.535 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 4.8 p-10 -124.65 -1.3 7.98 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.875 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 4.0 m -81.99 124.74 30.04 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 122.448 1.118 . . . . 0.0 110.275 -179.978 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -50.5 -23.59 2.59 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.359 178.618 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 17' ' ' THR . 9.7 t -153.85 129.73 10.18 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.632 -0.667 . . . . 0.0 109.22 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.0 -145.44 17.72 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.5 m -144.48 -161.35 1.27 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -1.139 . . . . 0.0 109.216 179.984 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 1.3 m -119.71 85.9 2.46 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.139 -0.975 . . . . 0.0 110.129 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -117.97 -176.28 3.01 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.769 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 48.27 23.36 0.54 Allowed 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.115 -0.991 . . . . 0.0 109.267 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.3 6.96 76.89 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.0 mttt -146.49 160.53 41.98 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.871 -1.37 . . . . 0.0 110.705 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.773 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.9 mmtp -137.69 176.21 8.9 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.072 -1.017 . . . . 0.0 110.491 -179.439 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -119.98 175.68 15.96 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.579 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.443 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -57.34 153.55 12.18 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.801 -1.411 . . . . 0.0 109.196 179.888 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.22 -29.95 10.84 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.928 -2.069 . . . . 0.0 107.928 -178.994 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.93 74.13 0.45 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.581 -0.952 . . . . 0.0 108.444 178.977 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.552 ' HA ' ' CB ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -32.51 152.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.407 0.622 . . . . 0.0 110.489 -179.442 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -169.76 -165.57 0.51 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.183 -0.948 . . . . 0.0 110.266 -179.614 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.439 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 39.7 m -92.76 -121.36 0.09 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.258 -0.901 . . . . 0.0 109.393 -179.424 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.508 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 12.8 mtm180 -143.23 115.48 8.45 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.678 -1.264 . . . . 0.0 109.415 -179.93 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.776 ' N ' HD23 ' A' ' 11' ' ' LEU . 1.3 mt 77.06 31.3 0.51 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.711 -0.618 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.496 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -78.92 -19.08 52.69 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.502 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.454 ' HB2' ' O ' ' A' ' 12' ' ' MET . 25.1 m-85 63.63 58.7 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.55 -0.719 . . . . 0.0 111.418 178.486 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.516 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -126.51 -14.81 5.73 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.945 -1.097 . . . . 0.0 109.717 179.095 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.2 m -73.51 129.37 37.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.296 1.045 . . . . 0.0 109.836 -179.943 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -60.87 -18.61 57.17 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.038 -179.743 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 18' ' ' GLY . 25.9 p -117.73 -111.56 0.34 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.113 -0.992 . . . . 0.0 109.257 -179.963 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -150.15 0.01 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 179.981 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.7 p -114.52 -165.98 1.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.345 -1.091 . . . . 0.0 109.65 -179.875 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 1.8 m -87.8 96.67 10.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.304 -0.872 . . . . 0.0 109.715 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -107.48 168.72 9.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.574 -0.704 . . . . 0.0 109.223 -179.679 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t 51.42 20.24 0.96 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.03 -1.044 . . . . 0.0 109.013 -179.52 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.466 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 78.35 2.77 84.79 Favored Glycine 0 N--CA 1.487 2.088 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.855 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.552 ' CB ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mttm -140.0 151.67 45.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.931 -1.335 . . . . 0.0 110.379 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.562 0 C-N-CA 119.91 -0.716 . . . . 0.0 109.41 179.816 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.1 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.6 mmmt -114.07 171.43 7.61 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.168 -0.958 . . . . 0.0 110.372 -179.36 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -119.3 149.13 18.12 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.434 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -44.79 158.4 0.06 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.132 -1.216 . . . . 0.0 109.952 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.04 -2.75 24.76 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.569 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.02 23.26 0.47 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.923 -1.34 . . . . 0.0 111.054 -179.82 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.577 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 1.4 ptmm? 46.93 175.64 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.537 -0.727 . . . . 0.0 109.66 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.577 ' CB ' ' O ' ' A' ' 7' ' ' LYS . 3.7 p 150.8 -172.73 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 CA-C-O 121.394 0.616 . . . . 0.0 109.754 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.458 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 13.9 t -93.35 -132.42 0.15 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.854 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' CYS . 6.7 ptt180 -120.66 -24.65 5.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.732 -1.23 . . . . 0.0 109.861 179.999 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.476 HD12 ' CG ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -108.86 8.96 26.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.195 -0.941 . . . . 0.0 109.51 -179.968 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.456 ' SD ' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -46.26 -49.83 16.8 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.28 -0.888 . . . . 0.0 109.345 179.971 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 54.11 29.22 9.99 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 109.554 179.965 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.456 ' OD2' ' SD ' ' A' ' 12' ' ' MET . 29.6 m-20 -100.98 -4.66 27.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.359 -0.838 . . . . 0.0 109.479 179.858 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -64.68 124.24 21.4 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.331 1.062 . . . . 0.0 109.301 179.572 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.69 -49.75 18.93 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.954 -179.889 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.9 72.72 1.5 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.14 -0.975 . . . . 0.0 109.506 -179.916 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.58 -165.77 34.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.5 p -129.99 -175.29 3.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.194 179.889 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -108.82 114.0 27.41 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.309 -0.87 . . . . 0.0 110.019 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' A' ' 22' ' ' SER . 24.3 mtp180 -145.21 149.34 34.76 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.735 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 80.07 -12.01 1.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.483 -0.761 . . . . 0.0 109.792 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.48 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . 118.53 -3.93 15.3 Favored Glycine 0 N--CA 1.488 2.157 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.286 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mtmt -146.54 164.55 32.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.732 -1.452 . . . . 0.0 111.417 -179.881 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.533 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.771 -179.546 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.1 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.324 0.583 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.702 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 1.7 mmmm -122.34 168.24 12.31 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.343 -0.848 . . . . 0.0 110.344 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.24 151.42 17.18 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.521 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -46.18 153.05 0.35 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.156 -1.203 . . . . 0.0 110.252 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.88 -18.74 5.74 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.702 ' HB1' ' HE3' ' A' ' 2' ' ' LYS . . . -78.23 46.45 0.61 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.761 -1.435 . . . . 0.0 110.703 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 52.53 164.15 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.221 -0.924 . . . . 0.0 110.824 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 5.0 p -161.17 170.53 20.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.527 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 6.7 t -98.71 -86.86 0.35 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.254 -0.904 . . . . 0.0 108.967 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HD2' ' O ' ' A' ' 9' ' ' SER . 13.1 mmm180 -156.72 -38.89 0.08 Allowed 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.15 42.14 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.288 -0.883 . . . . 0.0 109.325 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.527 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 79.9 mtp -83.38 -15.37 50.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.295 -0.878 . . . . 0.0 109.529 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 12' ' ' MET . 12.9 m-85 74.9 49.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.446 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -99.32 -38.93 8.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.304 -0.873 . . . . 0.0 109.163 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 8.1 m -54.96 122.84 11.77 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 122.381 1.086 . . . . 0.0 109.658 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -63.12 -37.95 89.25 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.661 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.46 ' O ' ' O ' ' A' ' 18' ' ' GLY . 41.7 p -104.53 -99.69 0.32 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.299 -0.876 . . . . 0.0 109.465 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -143.25 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.5 t -148.07 -162.88 1.64 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.25 -1.147 . . . . 0.0 109.532 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -46.74 132.2 11.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 110.225 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -146.18 128.86 16.18 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.41 -0.806 . . . . 0.0 109.141 179.09 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ARG . 46.7 t 44.15 25.97 0.13 Allowed 'General case' 0 C--N 1.296 -1.734 0 O-C-N 121.463 -0.773 . . . . 0.0 109.863 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.463 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 96.36 -26.44 21.44 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.5 mptp? -103.26 165.4 11.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.312 -1.111 . . . . 0.0 109.321 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.521 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -62.83 161.25 12.99 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.169 -0.957 . . . . 0.0 109.908 -179.474 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.428 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.302 -1.485 0 O-C-N 120.276 -1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.5 p . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.679 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.733 ' NZ ' ' HB1' ' A' ' 6' ' ' ALA . 5.6 mmmt -109.13 -141.34 0.38 Allowed 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.3 -0.875 . . . . 0.0 109.678 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 25' ' ' CYS . . . -178.87 163.0 30.42 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.457 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -47.84 149.07 1.39 Allowed 'General case' 0 C--N 1.307 -1.269 0 O-C-N 120.896 -1.356 . . . . 0.0 109.275 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.74 -39.99 3.1 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 108.454 -1.859 . . . . 0.0 108.454 -179.148 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.733 ' HB1' ' NZ ' ' A' ' 2' ' ' LYS . . . -67.32 71.41 0.11 Allowed 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.425 -1.044 . . . . 0.0 108.495 179.184 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.633 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.92 153.13 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.763 0.792 . . . . 0.0 110.697 -179.211 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -131.94 -174.81 3.53 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -179.377 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 4.0 m -90.33 -46.84 8.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.659 -1.276 . . . . 0.0 108.701 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 9' ' ' SER . 1.9 mmm180 179.2 -87.55 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.614 -0.678 . . . . 0.0 109.746 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.95 21.32 7.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.046 -1.034 . . . . 0.0 109.827 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.46 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -56.35 -25.3 48.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.244 -0.91 . . . . 0.0 109.184 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 48.07 64.9 1.46 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.359 -0.838 . . . . 0.0 109.788 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.507 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 1.1 m-20 -119.82 -24.77 6.05 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.18 -0.95 . . . . 0.0 109.541 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 4.1 m -53.45 120.79 6.54 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.42 1.105 . . . . 0.0 109.443 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -47.03 -35.14 6.42 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.694 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 38.7 p -85.89 -137.07 0.07 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -52.99 -105.06 0.01 OUTLIER Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.1 p -151.08 -158.26 0.9 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.038 -1.272 . . . . 0.0 109.785 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 7.2 m -68.03 137.27 54.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.368 -0.833 . . . . 0.0 109.698 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -125.92 125.08 42.18 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.232 -0.918 . . . . 0.0 109.091 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.8 p 50.52 22.42 1.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.384 -0.823 . . . . 0.0 109.335 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.98 -19.76 53.0 Favored Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.633 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -100.47 140.96 33.98 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.378 -1.072 . . . . 0.0 109.409 179.881 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.498 ' HB3' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER -57.32 171.74 0.38 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.02 -1.05 . . . . 0.0 108.916 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 119.809 -1.807 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.253 0.549 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 20.6 mmtm -112.98 165.06 12.7 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.236 -0.915 . . . . 0.0 110.314 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.56 163.33 19.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -52.02 155.43 1.86 Allowed 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.175 -1.191 . . . . 0.0 110.152 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 59.62 8.24 7.13 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 18.34 0.88 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.852 -1.381 . . . . 0.0 110.587 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.04 154.13 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.189 -0.944 . . . . 0.0 110.713 -179.86 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -157.06 178.8 9.94 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.775 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 8.9 t -91.74 -45.43 8.43 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.831 -1.168 . . . . 0.0 108.646 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.434 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 176.91 -83.42 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.866 0 O-C-N 121.753 -0.592 . . . . 0.0 109.771 179.126 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.99 24.17 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.272 -0.893 . . . . 0.0 109.756 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 74.5 mmm -61.33 -16.53 46.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.051 -1.031 . . . . 0.0 109.256 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 58.25 60.96 2.45 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 0.0 109.572 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -106.81 -26.05 11.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.406 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -55.41 122.18 10.62 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 122.349 1.071 . . . . 0.0 109.562 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -53.68 -43.15 68.64 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.846 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.709 HG23 ' O ' ' A' ' 17' ' ' THR . 6.7 t -139.86 88.08 2.21 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 109.521 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.67 -162.53 26.61 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.3 p -132.7 -165.51 1.61 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.257 -1.143 . . . . 0.0 109.371 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 23.5 m -92.03 136.51 33.11 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.186 -0.946 . . . . 0.0 109.697 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -125.38 106.94 10.2 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.19 -0.944 . . . . 0.0 108.813 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.74 12.38 7.59 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 121.592 -0.693 . . . . 0.0 109.336 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 7' ' ' LYS . . . 112.26 -16.5 24.72 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.9 mtpt -94.19 145.8 24.45 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.615 -0.932 . . . . 0.0 109.356 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.07 175.97 3.47 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.113 -0.992 . . . . 0.0 109.454 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.368 0 O-C-N 119.95 -1.719 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.421 0.629 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 10.1 mptt -97.67 167.42 10.97 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.329 -0.857 . . . . 0.0 109.785 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.19 170.69 17.13 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.341 -1.904 . . . . 0.0 108.341 179.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.445 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -49.38 147.27 3.34 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.738 -1.448 . . . . 0.0 108.896 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.23 -31.7 6.17 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.03 75.48 0.93 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.587 -0.949 . . . . 0.0 108.465 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.77 152.46 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.219 0.533 . . . . 0.0 110.58 -179.448 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.603 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.3 -177.6 4.79 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.603 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m -91.24 -62.5 1.43 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.791 -1.193 . . . . 0.0 109.074 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.497 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 166.01 102.4 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.497 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.18 15.64 1.37 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.599 -0.688 . . . . 0.0 109.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.439 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 3.9 mmm -69.71 -18.99 63.57 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.281 -0.887 . . . . 0.0 109.367 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.439 ' HB2' ' O ' ' A' ' 12' ' ' MET . 43.8 m-85 60.53 66.96 0.87 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.318 -0.864 . . . . 0.0 109.169 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -123.3 -22.44 5.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.356 -0.84 . . . . 0.0 109.767 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -64.27 119.93 11.22 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 122.483 1.135 . . . . 0.0 110.315 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.87 -38.37 55.79 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.42 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.48 102.71 4.53 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.389 -0.819 . . . . 0.0 109.397 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.99 -166.68 12.77 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.3 p -128.85 173.18 10.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.129 -1.219 . . . . 0.0 109.435 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.5 m -60.64 102.68 0.2 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.274 -0.891 . . . . 0.0 109.492 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.545 ' N ' ' O ' ' A' ' 24' ' ' LYS . 34.4 ttp180 -99.9 139.88 34.93 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.155 -0.965 . . . . 0.0 109.118 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 18.75 6.23 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.081 -1.012 . . . . 0.0 109.353 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.38 -11.9 70.81 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.9 mtpp -119.71 170.04 9.56 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.084 -1.245 . . . . 0.0 109.569 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.445 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m -72.05 159.76 33.63 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.187 -0.946 . . . . 0.0 109.472 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.623 0 O-C-N 120.271 -1.518 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.7 p . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.402 0.62 . . . . 0.0 109.598 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.569 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 6.5 mmtp -119.33 -179.98 4.02 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.495 -0.753 . . . . 0.0 110.108 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -123.74 163.49 17.31 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -44.81 158.88 0.05 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.216 -1.167 . . . . 0.0 109.308 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 90.08 -34.57 4.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 108.869 -1.692 . . . . 0.0 108.869 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.467 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.5 72.57 0.99 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.381 -1.07 . . . . 0.0 108.449 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -35.52 156.18 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.179 0.514 . . . . 0.0 110.406 -179.159 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.26 -177.32 4.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.025 -1.047 . . . . 0.0 108.448 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.3 -62.51 1.42 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.898 -1.126 . . . . 0.0 109.256 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.52 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 167.9 96.94 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 O-C-N 121.564 -0.71 . . . . 0.0 109.923 179.418 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.84 54.56 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.579 -0.701 . . . . 0.0 109.547 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.402 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -108.31 -18.8 13.67 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' MET . 88.9 m-85 60.46 80.94 0.19 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 2' ' ' LYS . 3.6 m-20 -144.93 -37.8 0.28 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.248 -0.908 . . . . 0.0 109.347 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -60.37 126.13 26.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.42 1.105 . . . . 0.0 108.661 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -59.43 -36.51 76.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 46.5 p -108.1 135.91 48.66 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.057 -1.027 . . . . 0.0 109.513 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 51.12 -150.4 6.61 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.63 -164.13 1.45 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.393 -1.063 . . . . 0.0 109.469 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -61.28 107.72 0.81 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.465 -0.772 . . . . 0.0 109.854 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -97.17 137.99 35.36 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.004 -1.06 . . . . 0.0 109.05 179.313 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.6 20.77 1.14 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.363 -0.836 . . . . 0.0 109.275 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.7 -16.73 60.1 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 61.2 mttt -106.06 174.08 6.04 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.11 -1.229 . . . . 0.0 110.157 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -73.4 162.65 29.06 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.92 -1.112 . . . . 0.0 108.819 179.664 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.493 0 O-C-N 120.103 -1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.639 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 7.0 mmtt -134.04 168.48 18.73 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.123 -0.986 . . . . 0.0 110.377 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -100.79 170.05 21.63 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -60.8 159.81 10.5 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.157 -1.202 . . . . 0.0 109.918 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 60.22 8.39 8.77 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -80.37 15.96 1.45 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.914 -1.345 . . . . 0.0 110.412 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.89 153.85 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.862 0.839 . . . . 0.0 110.675 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.609 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -159.64 -177.94 6.74 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.41 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.609 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.2 -56.0 3.39 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 120.875 -1.141 . . . . 0.0 108.563 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CB ' ' O ' ' A' ' 9' ' ' SER . 1.1 ptm180 159.33 101.15 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 121.306 0.574 . . . . 0.0 109.655 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.55 51.96 0.46 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.679 -0.638 . . . . 0.0 109.799 179.668 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.503 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 1.9 mtp -106.28 -7.56 17.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.373 -0.83 . . . . 0.0 109.275 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 54.19 51.6 14.16 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.457 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.503 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 9.3 m-20 -104.62 -14.46 15.61 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.478 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.9 m -67.18 124.53 23.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 122.496 1.141 . . . . 0.0 109.706 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -59.84 -9.91 3.39 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.489 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.3 p -133.14 1.6 3.53 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.713 -1.242 . . . . 0.0 111.093 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -178.1 -145.2 5.86 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.159 -1.496 . . . . 0.0 110.41 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -119.74 -171.02 2.05 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.392 -1.064 . . . . 0.0 109.326 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -70.29 142.14 52.29 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 110.172 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.24 125.39 43.51 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 31.0 p 54.94 17.94 2.03 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.553 -0.717 . . . . 0.0 109.465 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.94 -45.71 1.28 Allowed Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.902 -1.279 . . . . 0.0 109.902 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.5 mttt -93.52 162.14 14.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.281 -1.129 . . . . 0.0 109.758 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.9 OUTLIER -64.76 171.01 3.66 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.641 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.403 0 O-C-N 119.875 -1.766 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 3.9 mmtm -127.29 174.73 8.72 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -120.04 168.49 13.74 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -48.49 154.45 0.64 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.882 -1.364 . . . . 0.0 109.515 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.78 -40.04 2.84 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.536 -2.226 . . . . 0.0 107.536 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.19 78.61 0.97 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.414 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.751 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -35.86 157.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.767 0.794 . . . . 0.0 110.676 -178.671 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -132.73 -177.55 4.54 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -179.31 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.595 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.42 -45.75 8.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.708 -1.245 . . . . 0.0 109.261 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 31.1 ttt180 -175.08 -85.22 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.477 -0.764 . . . . 0.0 109.899 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.461 HD23 ' CZ ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -122.68 33.81 5.32 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.003 -1.061 . . . . 0.0 109.854 -179.671 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.2 mtt -67.8 -8.82 39.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.223 -0.923 . . . . 0.0 109.152 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 12' ' ' MET . 23.7 m-85 62.38 58.68 1.68 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.11 -41.21 5.89 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.216 -0.928 . . . . 0.0 109.315 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -55.3 123.77 14.89 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.439 1.114 . . . . 0.0 109.017 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.97 -28.79 54.24 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.065 -179.721 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 p -139.22 158.95 43.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.191 -0.943 . . . . 0.0 109.545 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 61.39 -146.81 48.11 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.4 p -150.85 171.12 17.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.253 -1.145 . . . . 0.0 109.602 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 20.9 m -56.5 114.9 2.22 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.377 -0.827 . . . . 0.0 109.553 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.0 mtt180 -119.03 141.82 48.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.124 -0.985 . . . . 0.0 109.247 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 11.2 t 51.4 21.98 1.34 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.166 -0.958 . . . . 0.0 109.068 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.63 -10.77 58.65 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.751 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.1 mttp -106.66 152.57 23.59 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.13 -1.217 . . . . 0.0 109.665 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.471 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.7 OUTLIER -63.06 167.8 4.61 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.596 179.486 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.541 0 O-C-N 119.972 -1.705 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.284 0.564 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.628 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 4.4 mmtp -119.07 169.89 9.53 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.178 -0.951 . . . . 0.0 110.041 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.48 177.47 18.48 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.873 -1.691 . . . . 0.0 108.873 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.6 pttt -59.53 153.63 19.2 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 120.89 -1.359 . . . . 0.0 109.447 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.66 -32.47 4.51 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -67.19 67.44 0.07 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.351 -1.087 . . . . 0.0 109.356 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -20.8 136.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.768 0.794 . . . . 0.0 111.831 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.2 -178.28 3.63 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.789 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.71 31.55 1.19 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 0.0 109.79 -178.898 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.7 ttm180 81.19 -43.59 0.19 Allowed 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.981 -0.449 . . . . 0.0 110.262 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -149.95 81.61 1.38 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.819 -1.176 . . . . 0.0 110.72 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.462 ' HG3' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -128.78 -9.19 4.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.101 -1.0 . . . . 0.0 109.613 178.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 58.22 59.55 3.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.036 -1.04 . . . . 0.0 109.85 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.01 -25.64 7.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.921 . . . . 0.0 109.181 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.4 m -56.75 123.75 16.05 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.393 1.092 . . . . 0.0 109.706 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.01 -19.89 34.58 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.236 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.4 p -93.52 -133.47 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.49 -0.756 . . . . 0.0 109.262 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.92 -95.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -147.54 -171.61 3.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.229 -1.16 . . . . 0.0 109.594 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.9 m -62.56 142.58 57.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.71 134.5 45.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.165 -0.959 . . . . 0.0 108.982 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.6 p 47.93 22.72 0.4 Allowed 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.504 -0.748 . . . . 0.0 109.415 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.25 -32.25 6.62 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.764 -1.334 . . . . 0.0 109.764 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.4 mttt -93.67 148.5 22.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.244 -1.151 . . . . 0.0 109.743 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.471 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -60.68 178.37 0.23 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.087 -1.008 . . . . 0.0 109.138 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 120.003 -1.686 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -110.19 165.01 12.09 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.238 -0.914 . . . . 0.0 110.233 -179.643 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.448 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -105.49 164.96 14.02 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -51.53 151.43 3.16 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.073 -1.251 . . . . 0.0 110.012 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.89 4.76 22.14 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.89 17.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.957 -1.32 . . . . 0.0 110.618 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.44 149.06 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.191 -0.943 . . . . 0.0 111.15 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -155.98 176.5 12.56 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.791 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.17 -53.7 4.13 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.033 -1.042 . . . . 0.0 108.712 179.365 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.516 ' CB ' ' O ' ' A' ' 9' ' ' SER . 7.6 ptt180 161.14 94.08 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 66.63 55.15 0.8 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.55 -0.719 . . . . 0.0 109.327 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.434 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -99.14 -9.48 23.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.438 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 12' ' ' MET . 14.2 m-85 69.02 31.56 4.08 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.17 -0.956 . . . . 0.0 109.607 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -97.9 -35.89 10.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.356 -0.84 . . . . 0.0 108.949 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -54.89 123.49 13.61 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 122.475 1.131 . . . . 0.0 109.989 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -62.61 -13.15 28.23 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.524 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.431 ' O ' ' C ' ' A' ' 18' ' ' GLY . 13.3 t -144.85 155.02 43.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 109.912 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.431 ' C ' ' O ' ' A' ' 17' ' ' THR . . . 42.11 -145.96 0.72 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.7 p -133.15 -166.53 1.78 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -1.101 . . . . 0.0 109.375 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.3 m -70.91 129.42 39.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.218 -0.926 . . . . 0.0 109.544 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -114.17 125.17 53.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.284 -0.885 . . . . 0.0 109.182 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.77 15.54 2.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.349 -0.844 . . . . 0.0 109.848 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.06 -34.78 5.23 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -93.68 165.84 12.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -1.188 . . . . 0.0 109.622 -179.681 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.55 170.22 4.19 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.151 -0.968 . . . . 0.0 109.649 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.32 0 O-C-N 119.878 -1.764 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 7.9 p . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.573 ' HD2' ' HB2' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -146.62 167.29 24.13 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.263 -0.898 . . . . 0.0 110.485 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.21 -172.15 28.54 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 108.599 -1.8 . . . . 0.0 108.599 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.1 160.07 6.63 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.858 -1.377 . . . . 0.0 109.312 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.41 -13.99 48.3 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HB2' ' HD2' ' A' ' 2' ' ' LYS . . . -73.26 60.83 0.61 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -1.09 . . . . 0.0 108.989 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.564 ' C ' ' O ' ' A' ' 6' ' ' ALA . 11.4 mtmt -18.36 131.67 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.836 0.827 . . . . 0.0 111.803 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.579 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.85 -179.2 3.94 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -179.712 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.579 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.4 -58.52 2.41 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.875 -1.141 . . . . 0.0 108.778 179.562 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.676 ' O ' HD12 ' A' ' 11' ' ' LEU . 10.2 ptm180 177.05 24.91 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.77 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 160.98 -18.35 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.05 -1.031 . . . . 0.0 110.624 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.464 ' C ' ' O ' ' A' ' 11' ' ' LEU . 1.1 mmt -39.03 -29.87 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.434 -0.791 . . . . 0.0 109.748 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.479 ' N ' ' O ' ' A' ' 11' ' ' LEU . 3.3 m-85 64.41 62.49 0.81 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.376 -0.828 . . . . 0.0 110.34 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -99.38 -15.16 18.87 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.089 -1.007 . . . . 0.0 108.992 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.8 m -64.7 125.04 23.51 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 122.252 1.025 . . . . 0.0 108.798 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -50.7 -52.73 37.38 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.195 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 17' ' ' THR . 4.8 t -135.61 59.31 1.72 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.001 -1.062 . . . . 0.0 109.642 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.67 -173.11 41.1 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.5 m -125.52 -169.13 1.94 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -1.185 . . . . 0.0 109.556 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.2 m -86.79 111.23 20.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.622 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -114.59 129.37 56.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.143 -0.973 . . . . 0.0 109.119 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.69 9.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.083 -1.01 . . . . 0.0 109.103 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.92 -9.22 69.82 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mttt -109.81 146.24 35.37 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.366 -1.079 . . . . 0.0 109.697 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.08 166.84 0.48 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.253 -0.904 . . . . 0.0 109.145 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.59 0 O-C-N 120.045 -1.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.7 p . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.141 0.496 . . . . 0.0 109.662 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 12.0 mmtm -116.08 163.07 16.48 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.328 -0.858 . . . . 0.0 110.187 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.26 167.06 22.35 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -61.05 159.54 11.49 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.134 -1.215 . . . . 0.0 110.172 -179.436 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.3 -0.64 15.92 Favored Glycine 0 N--CA 1.494 2.519 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.91 18.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.837 -1.39 . . . . 0.0 111.024 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.27 146.92 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.015 0.912 . . . . 0.0 111.076 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.566 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.6 p 172.48 178.11 0.08 Allowed 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.909 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 40.4 t -93.6 151.55 19.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.195 -0.941 . . . . 0.0 109.201 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 9' ' ' SER . 6.0 mtm180 -39.64 -37.88 0.56 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.47 ' O ' ' C ' ' A' ' 12' ' ' MET . 2.6 mp -85.88 -111.34 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.47 ' C ' ' O ' ' A' ' 11' ' ' LEU . 33.3 mtt 39.5 75.33 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.191 -0.943 . . . . 0.0 109.636 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -72.56 50.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.164 -0.96 . . . . 0.0 109.711 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.4 ' O ' ' C ' ' A' ' 15' ' ' CYS . 72.1 m-20 -95.02 -29.75 14.45 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.469 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 40.1 m -44.42 126.19 5.16 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 122.217 1.008 . . . . 0.0 109.667 179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -64.91 -6.17 7.76 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.666 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 p -138.65 25.54 2.59 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.762 -1.211 . . . . 0.0 110.742 -179.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.469 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . 145.45 -122.61 1.73 Allowed Glycine 0 N--CA 1.492 2.423 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.09 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 14.3 t -147.37 -163.71 1.83 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.335 -1.097 . . . . 0.0 109.321 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.534 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -78.29 132.85 37.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.18 -0.95 . . . . 0.0 111.381 -179.767 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.538 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.1 ttm180 -119.29 114.37 22.28 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 2.0 t 79.52 -23.7 0.23 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.705 -0.622 . . . . 0.0 110.365 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.439 ' C ' ' SG ' ' A' ' 20' ' ' CYS . . . 150.22 -14.29 0.97 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 110.037 -1.225 . . . . 0.0 110.037 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 45.9 mttt -128.46 156.64 42.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.905 -1.35 . . . . 0.0 110.494 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.566 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m -53.85 169.39 0.16 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 120.064 -0.654 . . . . 0.0 109.817 -179.218 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 120.101 -1.625 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 37.6 mmtt -125.18 172.5 9.47 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.208 -0.932 . . . . 0.0 110.402 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.91 172.74 14.37 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.477 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.1 pttm -58.78 155.62 12.59 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 120.885 -1.362 . . . . 0.0 109.516 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.51 -30.67 7.08 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.495 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.11 75.46 3.68 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.653 -0.91 . . . . 0.0 108.699 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.67 150.23 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.528 0.68 . . . . 0.0 110.48 -179.625 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -128.66 -178.15 4.48 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.368 -0.832 . . . . 0.0 109.124 -179.531 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.527 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.0 35.39 0.98 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.218 -0.926 . . . . 0.0 109.848 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 55.33 93.17 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.151 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.273 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.31 62.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.516 0.674 . . . . 0.0 109.717 -179.609 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.483 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 2.6 mtp -117.9 -21.16 8.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.351 -0.843 . . . . 0.0 108.971 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.4 m-30 60.73 48.04 7.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 109.645 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 30.9 m-20 -111.46 -31.18 7.11 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.232 -0.917 . . . . 0.0 109.51 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.0 m -50.72 122.39 7.22 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 122.311 1.053 . . . . 0.0 108.923 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.55 -26.89 9.41 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.356 -179.463 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -132.52 113.24 12.86 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.232 -0.918 . . . . 0.0 109.805 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 -140.13 17.2 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.6 p -140.92 -169.46 2.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -1.108 . . . . 0.0 109.248 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 m -60.43 153.43 23.06 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.167 -0.958 . . . . 0.0 109.358 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -122.72 108.74 13.4 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.358 -0.839 . . . . 0.0 109.161 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 44.46 26.08 0.16 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.694 -0.629 . . . . 0.0 109.395 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.463 ' HA3' ' NH2' ' A' ' 10' ' ' ARG . . . 111.5 -27.69 10.33 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.89 -1.284 . . . . 0.0 109.89 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.0 mttt -102.79 135.15 44.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.208 -1.172 . . . . 0.0 109.837 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.477 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -56.52 174.57 0.14 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.211 -0.93 . . . . 0.0 108.777 179.614 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.39 0 O-C-N 119.805 -1.809 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 121.241 0.543 . . . . 0.0 109.555 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.684 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 3.5 mmmt -113.57 169.75 8.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.312 -0.868 . . . . 0.0 109.744 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.79 172.35 18.15 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.548 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.0 OUTLIER -62.09 147.51 47.18 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.149 -1.207 . . . . 0.0 108.775 179.57 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.548 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 63.73 6.36 16.89 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.684 ' HB1' ' HE3' ' A' ' 2' ' ' LYS . . . -79.54 19.26 0.64 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.004 -1.291 . . . . 0.0 110.816 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.55 149.46 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.167 -0.958 . . . . 0.0 111.427 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.612 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -152.64 -178.05 6.62 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.612 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.14 -69.36 0.73 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 120.699 -1.251 . . . . 0.0 108.279 179.322 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 166.19 108.32 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.68 44.95 0.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.515 -0.741 . . . . 0.0 109.58 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.485 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 23.3 mmt -109.95 -23.3 11.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.314 -0.866 . . . . 0.0 109.236 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 62.74 52.34 2.81 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.367 -0.833 . . . . 0.0 109.796 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -101.99 -21.15 14.55 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.241 -0.912 . . . . 0.0 109.086 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.1 m -63.14 123.06 17.66 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 122.589 1.185 . . . . 0.0 109.811 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.04 -22.01 2.13 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.281 179.547 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.44 144.7 34.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.49 -0.756 . . . . 0.0 109.324 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.33 -146.93 45.68 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.5 m -144.46 -163.92 1.79 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.128 -1.219 . . . . 0.0 109.67 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 m -74.88 153.29 38.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.16 -0.962 . . . . 0.0 109.774 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 24' ' ' LYS . 5.1 ttt180 -145.77 116.08 7.51 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.459 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.458 ' HB2' ' CE ' ' A' ' 24' ' ' LYS . 34.8 m 61.42 15.54 6.7 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.457 -0.777 . . . . 0.0 109.565 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 103.01 -6.24 51.13 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.6 OUTLIER -110.7 161.67 15.52 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.284 -1.127 . . . . 0.0 109.64 -179.869 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.82 174.36 8.58 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.212 -0.93 . . . . 0.0 109.619 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 119.91 -1.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.1 p . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.335 0.588 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 25.4 mmtp -111.77 168.29 9.69 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.809 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -114.29 167.83 12.42 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.606 ' NZ ' HG21 ' A' ' 17' ' ' THR . 0.8 OUTLIER -46.91 165.44 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.306 -1.114 . . . . 0.0 110.074 -179.925 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 54.52 18.27 10.12 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.14 -1.584 . . . . 0.0 109.14 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.809 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -78.64 15.86 0.96 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.33 -1.1 . . . . 0.0 111.327 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.512 ' C ' ' O ' ' A' ' 6' ' ' ALA . 7.4 ptmm? 31.66 44.66 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 122.018 0.913 . . . . 0.0 109.68 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' N ' ' O ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -49.21 178.31 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 -178.917 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.555 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.25 36.4 0.99 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.042 -1.036 . . . . 0.0 109.57 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.638 ' HG2' HD23 ' A' ' 11' ' ' LEU . 2.0 ttp180 79.02 -80.94 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.978 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.638 HD23 ' HG2' ' A' ' 10' ' ' ARG . 2.0 mm? -115.53 79.62 1.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.001 -1.062 . . . . 0.0 109.487 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.463 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 2.8 mtt -122.53 -9.26 8.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 109.487 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 58.48 59.77 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.248 -0.907 . . . . 0.0 109.684 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -122.12 -21.21 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.679 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 19' ' ' SER . 57.5 m -58.32 119.63 7.27 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 122.483 1.135 . . . . 0.0 110.167 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.35 -18.4 4.05 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.707 179.402 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.606 HG21 ' NZ ' ' A' ' 4' ' ' LYS . 2.4 t -114.98 -121.28 0.3 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.942 . . . . 0.0 109.833 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.464 ' N ' HG23 ' A' ' 17' ' ' THR . . . -61.2 -131.37 0.01 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.446 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.8 t -115.05 -149.36 0.44 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -1.182 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 25.9 m -96.7 137.19 36.15 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 109.803 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 -107.08 117.02 32.97 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 50.11 23.04 1.04 Allowed 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.324 -0.86 . . . . 0.0 108.993 -179.208 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.597 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.76 -28.63 14.58 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.339 -1.505 . . . . 0.0 109.339 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 4.0 mttm -92.34 134.25 35.09 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.9 -1.353 . . . . 0.0 109.0 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 1.7 m -55.2 178.38 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.946 0 O-C-N 121.736 -0.603 . . . . 0.0 109.687 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.449 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.303 -1.428 0 O-C-N 120.01 -1.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.357 0.599 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.7 mmtt -126.9 172.93 10.0 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.261 -0.899 . . . . 0.0 110.443 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -113.78 -175.5 19.05 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 108.712 -1.755 . . . . 0.0 108.712 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.3 OUTLIER -62.59 145.18 55.08 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.775 -1.426 . . . . 0.0 108.108 179.411 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.539 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 106.22 -32.26 7.52 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 108.147 -1.981 . . . . 0.0 108.147 -178.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -72.24 76.14 0.99 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.5 153.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.463 0.649 . . . . 0.0 110.691 -179.263 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.578 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -137.14 -175.12 3.94 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.578 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.2 t -90.28 -44.11 9.93 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.457 -1.402 . . . . 0.0 109.771 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 9' ' ' SER . 3.0 ptm180 175.97 -34.76 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.82 0 O-C-N 121.332 -0.855 . . . . 0.0 109.981 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.81 23.4 0.77 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.2 mmt -60.27 -16.05 30.58 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.121 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 50.21 47.36 23.77 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.273 -0.892 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -94.67 -19.62 20.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 109.004 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 2.8 m -63.88 124.63 22.02 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.376 1.084 . . . . 0.0 108.522 179.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -50.65 -52.27 41.3 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.829 -179.21 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.7 p -115.97 -61.81 1.68 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.091 -1.006 . . . . 0.0 110.216 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.527 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -62.37 -162.44 0.27 Allowed Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.95 173.66 11.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.395 -1.062 . . . . 0.0 108.863 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 m -58.62 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.04 -1.037 . . . . 0.0 109.363 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 24' ' ' LYS . 12.0 ttm180 -96.95 122.06 39.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.098 -1.001 . . . . 0.0 109.404 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 t 58.6 30.69 20.19 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.416 -0.803 . . . . 0.0 109.485 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.16 -10.5 63.24 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.5 mtmt -109.45 141.51 41.77 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.283 -1.128 . . . . 0.0 109.546 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -55.34 165.14 0.81 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 109.295 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.599 0 O-C-N 120.152 -1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.8 p . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -120.76 176.58 5.46 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.1 -1.0 . . . . 0.0 110.294 -179.595 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -116.15 167.92 12.58 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.44 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -60.75 153.29 24.64 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.022 -1.281 . . . . 0.0 109.514 -179.737 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.409 ' HA2' ' HD2' ' A' ' 24' ' ' LYS . . . 62.67 -0.24 2.33 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.19 26.59 0.44 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.641 -1.505 . . . . 0.0 110.711 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 55.52 159.7 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 O-C-N 120.932 -1.105 . . . . 0.0 110.506 -179.765 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -162.88 -179.17 6.59 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 6.2 m -90.95 -50.22 5.99 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.764 -1.21 . . . . 0.0 108.808 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 175.26 -76.9 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.775 -0.578 . . . . 0.0 109.689 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.05 31.48 6.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.116 -0.99 . . . . 0.0 109.607 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.424 ' O ' ' C ' ' A' ' 13' ' ' TYR . 1.7 mmm -74.93 -4.98 41.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.26 -0.9 . . . . 0.0 109.44 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.424 ' C ' ' O ' ' A' ' 12' ' ' MET . 6.3 m-85 43.31 54.11 5.25 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.257 -0.902 . . . . 0.0 109.575 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.471 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -95.5 -20.55 18.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.228 -0.92 . . . . 0.0 109.129 179.766 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.4 m -56.89 121.73 10.59 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.588 1.185 . . . . 0.0 109.511 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.29 -36.15 41.08 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.011 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.524 HG23 ' O ' ' A' ' 17' ' ' THR . 3.0 t -146.25 78.43 1.52 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.167 -0.958 . . . . 0.0 109.757 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 146.94 -170.94 27.78 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.691 -1.364 . . . . 0.0 109.691 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.0 OUTLIER -121.91 -162.29 0.98 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.258 -1.142 . . . . 0.0 109.074 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 38.9 m -97.5 149.4 22.22 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.872 -1.142 . . . . 0.0 110.144 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 24' ' ' LYS . 31.7 mtt180 -146.31 136.76 23.94 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 50.08 26.14 1.98 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.183 -0.948 . . . . 0.0 109.244 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.1 31.16 39.63 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.7 mtmt -145.33 157.81 43.96 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.295 -1.12 . . . . 0.0 110.067 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER -73.23 173.27 9.71 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.784 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.404 0 O-C-N 120.046 -1.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.7 p . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.352 0.596 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.532 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 1.9 mptt -94.58 160.22 14.73 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.39 -0.819 . . . . 0.0 109.586 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.659 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -112.07 169.55 13.17 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.536 ' HA ' ' CB ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -44.91 166.83 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.288 -1.125 . . . . 0.0 109.238 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 58.94 15.27 27.52 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.659 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -77.98 14.0 1.25 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.26 -1.141 . . . . 0.0 111.135 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER 30.19 45.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 121.703 0.764 . . . . 0.0 110.4 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -54.47 -178.68 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -179.558 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.597 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.6 -45.99 8.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.716 -1.24 . . . . 0.0 109.334 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 9' ' ' SER . 3.7 mtt180 178.63 -94.57 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.56 -0.713 . . . . 0.0 109.747 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.409 ' HA ' HD22 ' A' ' 11' ' ' LEU . 2.8 mm? -90.58 43.08 1.13 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.112 -0.993 . . . . 0.0 109.705 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.447 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 2.9 mmt -75.75 -19.04 59.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.237 -0.914 . . . . 0.0 109.389 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 49.07 41.82 19.99 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.17 -0.956 . . . . 0.0 109.667 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.502 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 58.8 m-20 -102.69 -20.57 14.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 65.1 m -50.1 117.18 2.19 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 122.326 1.06 . . . . 0.0 110.332 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -48.91 -27.65 3.24 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.419 179.203 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.501 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.1 t -98.88 -118.55 0.14 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.476 -0.765 . . . . 0.0 109.742 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.501 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -71.65 -114.09 0.05 OUTLIER Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 p -128.35 -168.12 1.86 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.333 -1.098 . . . . 0.0 109.735 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 38.3 m -69.32 150.6 47.18 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.339 -0.851 . . . . 0.0 109.991 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -128.54 123.59 33.87 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER 45.1 26.18 0.22 Allowed 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.88 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.576 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 99.97 -36.67 3.95 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.485 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 3.6 mtmm -92.01 141.27 28.8 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.224 -1.162 . . . . 0.0 109.104 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.536 ' CB ' ' HA ' ' A' ' 4' ' ' LYS . 1.7 m -56.74 176.02 0.11 Allowed 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.577 -0.702 . . . . 0.0 109.609 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.476 0 O-C-N 120.132 -1.605 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.3 p . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.295 0.569 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtp -116.84 174.38 6.12 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.19 -0.944 . . . . 0.0 110.004 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.432 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -118.71 177.71 16.5 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.4 mtpt -60.48 147.61 40.61 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.08 -1.247 . . . . 0.0 110.063 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.93 -14.7 51.79 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.98 64.09 2.41 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.435 -1.038 . . . . 0.0 109.25 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.561 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.5 OUTLIER -11.49 128.33 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.802 0.81 . . . . 0.0 112.168 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.589 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.02 -178.51 3.52 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -179.685 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.83 -66.28 0.94 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 120.98 -1.075 . . . . 0.0 108.601 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.543 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ptt180 168.82 108.9 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 7.2 mt 70.19 12.5 7.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.871 -0.518 . . . . 0.0 110.401 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.459 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 8.6 mtt -67.24 -29.61 69.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.097 -1.002 . . . . 0.0 109.117 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.5 m-85 64.74 65.95 0.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.798 . . . . 0.0 110.223 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -118.62 -19.1 8.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -0.85 . . . . 0.0 109.134 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.5 m -60.59 123.95 18.92 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.495 1.14 . . . . 0.0 109.673 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -55.84 -41.55 74.46 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.702 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.8 89.41 2.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 109.528 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.03 -168.61 22.89 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -128.61 -167.37 1.76 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.138 -1.213 . . . . 0.0 109.682 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 35.2 m -84.5 96.37 9.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.189 -0.945 . . . . 0.0 109.682 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' N ' ' O ' ' A' ' 24' ' ' LYS . 11.1 ptp180 -102.84 137.19 41.38 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.95 -1.094 . . . . 0.0 108.913 179.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.85 19.04 10.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.154 -0.966 . . . . 0.0 109.116 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.18 -9.12 74.02 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 28.4 mtmt -111.74 173.21 6.46 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.171 -1.194 . . . . 0.0 109.764 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.8 OUTLIER -73.62 164.55 26.5 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.334 179.746 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.583 0 O-C-N 120.081 -1.637 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.346 0.594 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.535 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 7.1 mmtm -131.08 169.11 16.32 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.183 -0.948 . . . . 0.0 110.437 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.84 166.46 14.8 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.463 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.5 pttm -50.21 154.85 1.09 Allowed 'General case' 0 C--N 1.306 -1.315 0 O-C-N 120.972 -1.31 . . . . 0.0 109.212 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.97 -20.31 36.94 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.535 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -77.91 68.74 4.03 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.376 -1.073 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 8.5 mttt -20.17 138.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.898 0.856 . . . . 0.0 112.38 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.605 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.39 -178.28 4.7 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 179.856 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.605 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 28.4 t -90.3 -73.35 0.53 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.737 -1.227 . . . . 0.0 108.13 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.823 ' O ' HD12 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -167.82 17.88 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.536 -0.727 . . . . 0.0 110.459 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.823 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 157.7 36.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.418 -0.801 . . . . 0.0 109.494 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.414 ' O ' ' C ' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -82.54 8.68 11.08 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 109.518 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' HD23 ' A' ' 11' ' ' LEU . 8.0 m-85 44.28 49.51 7.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.532 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.497 ' O ' ' N ' ' A' ' 2' ' ' LYS . 6.0 p-10 -103.55 -35.3 8.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.211 -0.931 . . . . 0.0 109.534 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 4.0 m -61.11 125.14 22.65 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 122.349 1.071 . . . . 0.0 110.004 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -65.47 -33.19 75.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.884 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 1.3 t -117.94 -115.48 0.33 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -42.82 165.5 0.02 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.4 t -91.56 -174.46 3.89 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.308 -1.113 . . . . 0.0 109.555 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.2 m -61.18 105.18 0.46 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.324 -0.86 . . . . 0.0 109.46 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . 2.5 tmt_? -96.21 135.76 37.59 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.057 -1.027 . . . . 0.0 109.06 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.453 ' OG ' ' HD3' ' A' ' 21' ' ' ARG . 20.2 m 47.24 23.42 0.32 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.162 -0.961 . . . . 0.0 109.483 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.55 -20.26 49.35 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.596 -1.401 . . . . 0.0 109.596 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.8 mtmp? -101.72 148.5 25.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -1.146 . . . . 0.0 109.716 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.463 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.1 m -57.41 163.91 2.11 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.39 0 O-C-N 119.916 -1.74 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.4 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.261 0.553 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 28.5 mmtm -112.55 164.77 12.91 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -104.74 167.34 15.29 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.493 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 1.2 tttp -52.0 153.03 2.81 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.141 -1.211 . . . . 0.0 110.086 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.5 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 60.74 3.92 3.7 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.54 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.94 20.66 0.76 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.805 -1.409 . . . . 0.0 110.903 -179.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.54 ' O ' ' O ' ' A' ' 6' ' ' ALA . 13.4 mtpt 52.66 123.34 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 122.688 1.232 . . . . 0.0 111.379 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.08 -178.47 3.51 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.121 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.565 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -92.26 35.68 1.0 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.054 -1.029 . . . . 0.0 109.531 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.503 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 78.14 -54.83 0.5 Allowed 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.018 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.93 43.21 0.97 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.088 -1.007 . . . . 0.0 109.711 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.549 ' HB2' ' HB2' ' A' ' 9' ' ' SER . 0.1 OUTLIER -93.54 -3.89 52.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.0 109.555 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 55.89 55.86 6.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.249 -0.907 . . . . 0.0 109.766 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -102.89 -23.0 13.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.21 -0.931 . . . . 0.0 109.352 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.9 m -55.55 121.38 8.92 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 122.37 1.081 . . . . 0.0 109.629 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -48.07 -50.08 29.41 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.653 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 17' ' ' THR . 10.2 t -141.26 89.3 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.282 -0.886 . . . . 0.0 109.454 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.02 -173.42 28.07 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 m -121.35 -175.18 3.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -1.175 . . . . 0.0 109.5 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.0 m -93.43 131.53 38.54 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.257 -0.902 . . . . 0.0 109.747 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 24' ' ' LYS . 39.2 ttp180 -119.6 119.78 34.77 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.322 -0.862 . . . . 0.0 109.235 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 59.03 15.38 3.97 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.352 -0.843 . . . . 0.0 109.577 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.04 -16.2 39.31 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.881 -1.287 . . . . 0.0 109.881 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 6.0 mtpt -94.98 154.57 17.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.232 -1.157 . . . . 0.0 109.468 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.415 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -70.21 178.87 2.62 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.037 -1.04 . . . . 0.0 109.494 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.493 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 119.92 -1.737 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.275 0.56 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 39.3 mmtt -119.05 -178.99 3.69 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.083 -1.011 . . . . 0.0 110.108 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -140.4 163.25 26.45 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.72 149.34 0.62 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.914 -1.344 . . . . 0.0 109.643 -179.727 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 92.35 -39.41 3.01 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.53 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.62 78.15 0.43 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.365 -1.079 . . . . 0.0 108.145 178.859 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.9 ptpp? -34.8 159.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.416 0.627 . . . . 0.0 110.265 -179.229 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.592 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -138.84 -175.07 4.02 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -179.61 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.592 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -89.79 -47.29 8.0 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.688 -1.257 . . . . 0.0 108.696 -179.764 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.551 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 173.44 -73.09 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.533 -0.73 . . . . 0.0 110.302 178.634 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.28 58.37 0.82 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.02 -1.05 . . . . 0.0 110.279 -179.272 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmt -101.36 -14.6 17.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.037 -1.039 . . . . 0.0 108.7 178.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 50.37 68.21 0.8 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.396 -0.815 . . . . 0.0 109.925 179.606 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB3' ' CG ' ' A' ' 2' ' ' LYS . 3.9 m-20 -115.35 -21.5 9.82 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 108.79 179.238 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -60.15 123.06 16.01 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.627 1.203 . . . . 0.0 109.188 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.75 -32.84 14.62 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.25 -179.681 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 p -138.62 122.08 17.24 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.907 . . . . 0.0 109.601 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.62 -156.83 26.02 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.6 t -138.5 -179.8 6.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.274 -1.133 . . . . 0.0 109.357 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.496 ' N ' ' OG ' ' A' ' 19' ' ' SER . 19.6 m -59.21 111.2 1.26 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.526 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 24' ' ' LYS . 15.3 tpt180 -103.77 127.52 51.24 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.995 -1.065 . . . . 0.0 109.134 179.345 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 69.59 14.83 8.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.328 -179.684 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.38 -16.76 59.49 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.7 mtpt -114.05 175.55 5.42 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.229 -1.16 . . . . 0.0 109.63 -179.884 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -73.32 170.2 15.54 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.083 -1.047 . . . . 0.0 108.61 179.656 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.514 0 O-C-N 120.072 -1.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.208 0.528 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtm -107.73 166.93 10.32 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.293 -0.879 . . . . 0.0 109.945 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.89 -178.12 26.73 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -60.75 154.85 20.63 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.064 -1.256 . . . . 0.0 110.555 -179.585 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.419 ' HA2' ' HB2' ' A' ' 24' ' ' LYS . . . 45.91 18.47 0.26 Allowed Glycine 0 N--CA 1.494 2.526 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.14 25.88 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.951 -1.323 . . . . 0.0 110.607 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.2 mtmp? 55.25 150.79 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 122.126 0.965 . . . . 0.0 111.266 179.918 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -156.68 177.08 11.89 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.623 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.553 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -92.0 -44.97 8.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.089 -1.007 . . . . 0.0 108.392 179.196 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.469 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 3.3 ttp180 168.17 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.8 0 O-C-N 121.667 -0.645 . . . . 0.0 109.653 179.053 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 13' ' ' TYR . 0.4 OUTLIER -131.39 27.21 4.77 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.065 -1.022 . . . . 0.0 109.87 -179.878 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.5 -10.59 46.14 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.865 . . . . 0.0 109.787 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.648 ' CE1' HD23 ' A' ' 11' ' ' LEU . 12.5 m-30 55.84 59.77 3.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.203 -0.936 . . . . 0.0 109.402 -179.951 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.46 -24.05 10.39 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.404 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.3 m -59.56 122.05 13.08 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 122.7 1.238 . . . . 0.0 110.056 -179.844 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -57.9 -20.29 35.99 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.743 179.673 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 17' ' ' THR . 2.9 t -154.57 123.62 6.33 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.7 175.31 50.68 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 179.831 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -169.62 1.67 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.294 -1.121 . . . . 0.0 109.599 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.7 m -75.25 146.48 41.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.152 -0.967 . . . . 0.0 109.446 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -135.33 117.03 14.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.287 -0.883 . . . . 0.0 109.483 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 7.3 t 71.12 4.51 5.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.487 -0.758 . . . . 0.0 109.655 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.36 -1.36 28.03 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -123.37 176.3 6.22 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.348 -1.089 . . . . 0.0 109.191 179.841 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.44 176.22 7.0 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.416 -0.802 . . . . 0.0 109.684 179.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.36 0 O-C-N 119.88 -1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.294 0.568 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.6 mmmm -106.47 -156.9 0.59 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.357 -0.839 . . . . 0.0 109.661 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -157.31 165.09 33.23 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.63 153.96 0.23 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 120.941 -1.329 . . . . 0.0 109.822 -179.687 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.468 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 86.92 -42.35 3.15 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.773 -1.731 . . . . 0.0 108.773 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -67.73 73.55 0.17 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.43 -1.041 . . . . 0.0 108.253 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -35.26 158.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.555 0.693 . . . . 0.0 110.478 -178.82 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.11 -177.8 4.46 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.806 -178.618 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.572 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -91.77 34.96 0.97 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.311 -0.868 . . . . 0.0 109.725 -179.246 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.572 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 87.89 -75.62 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.638 179.347 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.99 42.88 2.71 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.905 -1.122 . . . . 0.0 110.714 -178.897 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.454 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -83.15 -21.8 33.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.95 -1.094 . . . . 0.0 108.586 179.16 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 56.96 71.87 0.55 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.546 -0.721 . . . . 0.0 110.071 179.436 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 2.2 m-20 -122.95 -15.26 7.42 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.282 -0.886 . . . . 0.0 109.725 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.4 m -67.6 122.3 17.74 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.559 1.171 . . . . 0.0 109.73 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.73 -43.12 47.52 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.362 179.895 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 18' ' ' GLY . 6.6 p -88.66 -116.26 0.06 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.047 -1.033 . . . . 0.0 109.645 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.96 -144.56 0.01 OUTLIER Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -124.17 -148.89 0.41 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.162 -1.199 . . . . 0.0 109.445 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.3 m -79.52 110.8 15.18 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.335 -0.853 . . . . 0.0 109.518 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -102.45 138.22 39.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 109.113 179.536 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 t 47.71 27.58 1.09 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.223 -179.646 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.4 -17.01 41.22 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -102.49 157.67 16.76 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.254 -1.145 . . . . 0.0 109.482 -179.906 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -64.71 169.8 4.71 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 118.831 -1.148 . . . . 0.0 108.305 179.186 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.463 0 O-C-N 119.98 -1.7 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.451 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 11.8 p . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.512 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 8.8 mmtt -128.26 173.14 10.4 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.048 -1.032 . . . . 0.0 110.514 -179.204 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.83 162.46 12.36 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.476 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -55.18 156.08 4.37 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 120.943 -1.327 . . . . 0.0 109.32 -179.911 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.39 -28.19 10.4 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.271 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.24 75.96 3.79 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 121.544 -0.974 . . . . 0.0 108.711 179.328 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.666 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -29.79 146.35 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 121.554 0.692 . . . . 0.0 110.766 -179.607 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -126.76 -175.2 3.34 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -179.549 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.42 -52.34 4.96 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.802 -1.186 . . . . 0.0 108.994 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.538 ' CB ' ' O ' ' A' ' 9' ' ' SER . 31.5 ttm180 158.35 100.98 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 76.08 14.44 2.54 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.675 -0.641 . . . . 0.0 109.468 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mtp -61.23 -21.28 63.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.4 -0.812 . . . . 0.0 108.869 179.54 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD2' ' O ' ' A' ' 11' ' ' LEU . 53.8 m-85 60.3 68.63 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.313 -0.867 . . . . 0.0 109.891 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -127.18 -30.88 2.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.922 . . . . 0.0 109.606 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -50.53 124.62 11.1 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.01 -1.057 . . . . 0.0 109.036 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -58.22 -27.84 64.31 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.13 -179.713 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.693 HG23 ' O ' ' A' ' 17' ' ' THR . 5.3 t -131.47 92.97 3.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.657 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.76 -150.65 16.92 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.85 173.59 11.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.401 -1.058 . . . . 0.0 109.281 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.1 m -45.24 135.64 5.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.447 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.432 ' HG3' HH11 ' A' ' 21' ' ' ARG . 19.3 ttm-85 -115.94 118.59 33.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 109.377 179.787 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 44.88 25.35 0.15 Allowed 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.391 -0.818 . . . . 0.0 109.982 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.65 -43.02 1.8 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.666 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -92.78 152.14 19.63 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.078 -1.248 . . . . 0.0 110.416 -179.125 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -67.61 170.2 8.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.397 -0.814 . . . . 0.0 109.203 179.788 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.531 0 O-C-N 119.972 -1.705 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.238 0.542 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 6' ' ' ALA . 9.4 mmtp -115.57 178.42 4.31 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.231 -0.918 . . . . 0.0 110.336 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.458 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.54 169.82 17.47 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.579 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -40.1 149.88 0.06 Allowed 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.362 -1.081 . . . . 0.0 110.213 -179.767 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 89.28 -42.71 3.02 Favored Glycine 0 N--CA 1.487 2.055 0 N-CA-C 108.726 -1.75 . . . . 0.0 108.726 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . . . -64.99 74.79 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.4 -1.059 . . . . 0.0 108.605 179.335 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.27 150.31 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.865 0.841 . . . . 0.0 111.116 -179.748 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -134.69 176.72 8.38 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.198 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.579 ' O ' ' C ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -92.49 112.99 25.14 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.692 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.579 ' C ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -13.6 88.39 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.267 0 CA-C-O 121.443 0.64 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.533 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 2.0 tt 79.59 106.3 0.07 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.682 -0.636 . . . . 0.0 109.789 -179.689 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.566 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -159.63 -35.34 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.503 -0.748 . . . . 0.0 109.452 179.626 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.566 ' CD2' ' O ' ' A' ' 12' ' ' MET . 13.5 m-85 86.51 44.59 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.802 -0.561 . . . . 0.0 110.352 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.458 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 1.1 m-20 -102.4 -36.06 8.57 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.697 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.1 m -58.11 124.96 21.14 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.455 1.121 . . . . 0.0 108.733 179.106 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.17 -27.43 63.82 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.669 -179.613 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -144.07 -81.45 0.18 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.219 -0.926 . . . . 0.0 110.046 -179.628 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -41.12 163.87 0.01 OUTLIER Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -179.486 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.54 171.32 7.43 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -1.156 . . . . 0.0 109.718 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.4 m -75.11 89.66 2.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.231 -0.918 . . . . 0.0 109.513 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -108.42 142.01 39.42 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.013 -1.054 . . . . 0.0 109.631 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.34 37.35 18.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.409 -0.807 . . . . 0.0 108.936 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.73 9.8 47.13 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -179.513 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 30.0 mtpt -117.99 141.06 48.86 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 121.292 -1.122 . . . . 0.0 110.342 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -56.13 171.21 0.27 Allowed 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.081 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.467 0 O-C-N 119.909 -1.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 15.7 mmtt -126.35 171.57 10.86 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.329 -0.857 . . . . 0.0 110.237 -179.744 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.49 176.12 16.02 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.027 -1.629 . . . . 0.0 109.027 179.644 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -55.47 150.21 12.24 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.001 -1.293 . . . . 0.0 109.687 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.53 -28.27 16.24 Favored Glycine 0 N--CA 1.487 2.042 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -179.27 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.538 ' CB ' ' HD2' ' A' ' 2' ' ' LYS . . . -69.48 73.57 0.36 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.679 -0.895 . . . . 0.0 108.671 179.214 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.84 150.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.188 0.518 . . . . 0.0 110.021 -179.768 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -163.58 -167.53 1.44 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.163 -0.961 . . . . 0.0 110.266 -179.44 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.53 -93.19 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.263 -0.898 . . . . 0.0 109.774 -179.532 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.8 OUTLIER -170.88 115.48 0.44 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.406 -0.809 . . . . 0.0 109.341 -179.748 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 80.37 13.99 0.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.624 -0.673 . . . . 0.0 109.346 -179.916 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -60.75 -21.79 63.37 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.31 -0.868 . . . . 0.0 109.212 179.84 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 12' ' ' MET . 3.6 m-85 63.9 52.28 2.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.432 -0.792 . . . . 0.0 110.261 179.448 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -121.65 -29.46 4.36 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.077 -1.015 . . . . 0.0 109.478 179.51 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 3.9 m -57.29 123.79 16.6 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.362 1.077 . . . . 0.0 109.382 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -56.33 -28.42 58.86 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.909 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.569 HG23 ' O ' ' A' ' 17' ' ' THR . 4.6 t -142.64 112.65 7.02 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.908 . . . . 0.0 109.372 -179.985 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.58 -144.41 15.82 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.1 p -151.39 176.68 11.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.186 -1.185 . . . . 0.0 109.778 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 7.9 m -88.7 103.47 15.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.383 -0.823 . . . . 0.0 109.322 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 22' ' ' SER . 44.2 mtp180 -116.64 143.26 45.84 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.303 -179.377 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 79.35 -36.26 0.17 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 109.926 -179.867 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.489 ' C ' ' HG3' ' A' ' 24' ' ' LYS . . . 143.77 -3.01 1.51 Allowed Glycine 0 N--CA 1.487 2.09 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 179.928 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mtmt -141.46 148.64 39.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.706 -1.467 . . . . 0.0 110.764 -179.658 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.559 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER -55.48 165.51 0.79 Allowed 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.762 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.478 0 O-C-N 120.03 -1.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.474 ' C ' ' HD2' ' A' ' 2' ' ' LYS . 17.5 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.334 0.588 . . . . 0.0 109.804 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.589 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 2.0 mptp? -105.13 178.42 4.57 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.422 -0.799 . . . . 0.0 109.915 -179.671 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.7 169.66 22.72 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 108.63 -1.788 . . . . 0.0 108.63 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.448 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 8.0 ptmt -53.07 154.33 3.07 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 120.914 -1.344 . . . . 0.0 109.038 -179.995 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.9 -26.87 12.53 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.898 -2.081 . . . . 0.0 107.898 -178.846 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.88 75.89 3.48 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.936 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -30.49 148.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.35 0.595 . . . . 0.0 110.243 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.585 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -164.67 -162.24 0.63 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.042 -1.036 . . . . 0.0 110.057 -179.648 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.512 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 1.0 OUTLIER -92.32 -141.14 0.2 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.853 -1.154 . . . . 0.0 109.22 -179.567 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -103.05 -64.2 1.1 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.032 -1.042 . . . . 0.0 109.99 -179.566 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.01 50.08 0.87 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.172 -0.955 . . . . 0.0 110.135 -179.573 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.512 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -80.13 -36.66 34.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.148 -0.97 . . . . 0.0 109.034 179.379 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 12' ' ' MET . 29.8 m-85 61.47 48.14 6.12 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.424 -0.798 . . . . 0.0 110.066 179.461 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.473 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -110.04 -11.1 14.66 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.178 -0.951 . . . . 0.0 109.04 179.387 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.9 m -69.07 122.53 18.92 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.339 1.066 . . . . 0.0 109.281 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -46.88 -54.78 9.24 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.988 -179.817 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 t -133.51 54.75 1.93 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.98 . . . . 0.0 109.454 -179.908 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -172.04 -158.06 15.32 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 179.938 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.6 m -143.03 170.07 16.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.173 -1.192 . . . . 0.0 109.683 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 9' ' ' SER . 64.1 m -93.5 85.32 4.89 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.479 -0.763 . . . . 0.0 108.998 179.767 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.528 ' O ' ' CB ' ' A' ' 22' ' ' SER . 31.8 ttp180 -100.25 134.04 43.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.616 -0.677 . . . . 0.0 109.558 -179.148 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER 79.56 -8.77 1.54 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.601 -0.687 . . . . 0.0 109.415 -179.517 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 116.69 -3.54 19.63 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.231 179.693 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -132.58 147.69 52.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.612 -1.523 . . . . 0.0 110.794 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.585 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -55.73 170.92 0.24 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.21 179.874 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.43 0 O-C-N 119.836 -1.79 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.288 0.566 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -120.77 166.9 13.1 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.139 -0.975 . . . . 0.0 110.086 -179.77 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -102.69 162.98 16.35 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -179.929 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.446 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.0 OUTLIER -54.31 161.81 1.25 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.211 -1.17 . . . . 0.0 109.85 -179.774 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.83 18.28 1.8 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -80.4 17.09 1.13 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.968 -1.313 . . . . 0.0 110.574 179.887 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.546 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER 52.68 129.26 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 122.53 1.157 . . . . 0.0 111.559 179.449 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.569 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.4 p -167.58 -168.69 1.06 Allowed 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.564 -0.71 . . . . 0.0 110.3 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 m -93.38 -129.95 0.13 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 109.553 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CZ ' ' HG3' ' A' ' 21' ' ' ARG . 16.6 tpt180 -137.77 109.67 7.18 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 120.807 -1.183 . . . . 0.0 109.419 -179.687 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.542 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 78.13 59.72 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.479 -0.763 . . . . 0.0 109.598 -179.993 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.4 mmm -118.28 -2.81 11.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 109.619 179.901 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 53.28 69.41 0.71 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.172 -0.955 . . . . 0.0 110.046 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.61 -29.86 1.32 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.327 -0.858 . . . . 0.0 109.772 179.559 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 5.6 m -60.42 121.12 11.3 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.452 1.12 . . . . 0.0 109.63 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.62 -35.57 21.55 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.108 -179.987 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.4 t -153.22 56.64 0.77 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.159 -0.963 . . . . 0.0 109.571 -179.898 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.25 -160.38 22.99 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.58 173.85 10.7 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.303 -1.116 . . . . 0.0 109.325 179.992 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 8.2 m -111.81 91.89 3.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.345 179.86 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.557 ' HG3' ' CZ ' ' A' ' 10' ' ' ARG . 2.2 ttm180 -126.67 153.68 45.08 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.405 -0.809 . . . . 0.0 109.204 -179.458 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 78.69 -35.15 0.17 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.335 -0.853 . . . . 0.0 110.111 -179.961 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.31 -4.96 1.36 Allowed Glycine 0 N--CA 1.486 2.021 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.309 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -146.65 162.74 37.82 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.594 -1.533 . . . . 0.0 110.431 -179.914 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.569 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -56.91 174.77 0.15 Allowed 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.002 -179.548 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.446 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.305 -1.347 0 O-C-N 119.979 -1.7 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.297 0.57 . . . . 0.0 109.676 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.2 mmtt -122.72 172.68 8.25 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.306 -0.871 . . . . 0.0 110.413 -179.261 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -127.67 163.75 21.29 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.743 -1.743 . . . . 0.0 108.743 179.434 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.469 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 4.4 pttt -49.77 154.88 0.94 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.885 -1.362 . . . . 0.0 109.071 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.421 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.05 -31.51 6.57 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.766 -2.134 . . . . 0.0 107.766 -178.724 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.71 74.45 0.42 Allowed 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.02 148.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.386 0.612 . . . . 0.0 110.58 -179.369 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.567 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.9 OUTLIER -170.08 -169.37 0.85 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.871 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 10.3 t -93.8 160.49 14.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.943 . . . . 0.0 109.927 -179.354 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.624 ' O ' HD12 ' A' ' 11' ' ' LEU . 10.1 ttp180 -72.42 71.45 0.93 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.348 179.869 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 159.45 -16.24 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.732 -0.605 . . . . 0.0 110.238 179.801 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.466 ' C ' ' O ' ' A' ' 11' ' ' LEU . 4.0 mmm -38.48 -47.19 1.25 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.378 -0.826 . . . . 0.0 109.697 -179.772 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 58.86 26.24 14.61 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 109.531 179.734 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' CE ' ' A' ' 12' ' ' MET . 71.7 m-20 -95.26 -6.32 41.67 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.088 -1.007 . . . . 0.0 109.2 179.611 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.5 m -60.9 126.47 27.5 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.478 1.132 . . . . 0.0 109.089 179.608 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.28 -22.91 0.28 Allowed 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.403 -179.578 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -137.22 -85.88 0.31 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.942 -1.099 . . . . 0.0 110.052 179.867 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.487 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -57.23 -153.54 0.01 OUTLIER Glycine 0 N--CA 1.491 2.361 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.434 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 83.5 p -129.65 -166.04 1.61 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.317 -1.108 . . . . 0.0 109.812 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 21.4 m -98.3 93.79 6.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.257 -0.902 . . . . 0.0 109.773 -179.711 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' O ' ' HB3' ' A' ' 22' ' ' SER . 27.4 ttp180 -112.97 156.58 22.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.552 -0.717 . . . . 0.0 109.33 -179.431 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.441 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 31.4 t 63.22 10.68 4.79 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.243 -0.911 . . . . 0.0 109.338 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 94.58 -5.75 70.36 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.967 -1.111 . . . . 0.0 110.368 179.647 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -136.07 154.54 50.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.675 -1.485 . . . . 0.0 110.93 -179.249 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.567 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER -55.61 176.56 0.06 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.066 179.587 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.409 0 O-C-N 119.946 -1.722 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.305 0.574 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.3 mmtp -112.6 176.12 5.15 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.231 -0.918 . . . . 0.0 109.89 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.407 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -113.78 159.08 13.89 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.175 -1.57 . . . . 0.0 109.175 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -52.47 159.0 1.09 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.24 -1.153 . . . . 0.0 110.075 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.95 15.74 1.06 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.675 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.07 23.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.786 -1.42 . . . . 0.0 110.702 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER 55.34 154.67 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.177 -0.952 . . . . 0.0 110.729 -179.759 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.8 p 163.45 -168.37 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.554 -0.716 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.45 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 1.5 t -92.35 -139.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.45 -0.781 . . . . 0.0 109.561 -179.243 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.576 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER -137.74 114.48 10.55 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.023 -1.048 . . . . 0.0 109.722 -179.455 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.576 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.92 6.67 0.28 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.087 0.47 . . . . 0.0 110.472 179.442 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.427 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -66.52 -30.1 70.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.99 -1.069 . . . . 0.0 108.364 178.962 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 12' ' ' MET . 1.1 m-85 65.35 66.25 0.54 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.536 -0.728 . . . . 0.0 110.166 179.535 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 4.8 p-10 -124.65 -1.3 7.98 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.875 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 4.0 m -81.99 124.74 30.04 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 122.448 1.118 . . . . 0.0 110.275 -179.978 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -50.5 -23.59 2.59 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.359 178.618 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 17' ' ' THR . 9.7 t -153.85 129.73 10.18 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.632 -0.667 . . . . 0.0 109.22 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.0 -145.44 17.72 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.5 m -144.48 -161.35 1.27 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -1.139 . . . . 0.0 109.216 179.984 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 1.3 m -119.71 85.9 2.46 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.139 -0.975 . . . . 0.0 110.129 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -117.97 -176.28 3.01 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.769 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 48.27 23.36 0.54 Allowed 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.115 -0.991 . . . . 0.0 109.267 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.3 6.96 76.89 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.0 mttt -146.49 160.53 41.98 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.871 -1.37 . . . . 0.0 110.705 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -54.62 -173.92 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.773 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.442 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.306 -1.292 0 O-C-N 119.865 -1.772 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.9 mmtp -137.69 176.21 8.9 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.072 -1.017 . . . . 0.0 110.491 -179.439 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -119.98 175.68 15.96 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.579 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.443 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -57.34 153.55 12.18 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.801 -1.411 . . . . 0.0 109.196 179.888 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.22 -29.95 10.84 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.928 -2.069 . . . . 0.0 107.928 -178.994 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.93 74.13 0.45 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.581 -0.952 . . . . 0.0 108.444 178.977 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.552 ' HA ' ' CB ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -32.51 152.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.407 0.622 . . . . 0.0 110.489 -179.442 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -169.76 -165.57 0.51 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.183 -0.948 . . . . 0.0 110.266 -179.614 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.439 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 39.7 m -92.76 -121.36 0.09 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.258 -0.901 . . . . 0.0 109.393 -179.424 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.508 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 12.8 mtm180 -143.23 115.48 8.45 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.678 -1.264 . . . . 0.0 109.415 -179.93 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.776 ' N ' HD23 ' A' ' 11' ' ' LEU . 1.3 mt 77.06 31.3 0.51 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.711 -0.618 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.496 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -78.92 -19.08 52.69 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.502 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.454 ' HB2' ' O ' ' A' ' 12' ' ' MET . 25.1 m-85 63.63 58.7 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.55 -0.719 . . . . 0.0 111.418 178.486 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.516 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -126.51 -14.81 5.73 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.945 -1.097 . . . . 0.0 109.717 179.095 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.2 m -73.51 129.37 37.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.296 1.045 . . . . 0.0 109.836 -179.943 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -60.87 -18.61 57.17 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.038 -179.743 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 18' ' ' GLY . 25.9 p -117.73 -111.56 0.34 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.113 -0.992 . . . . 0.0 109.257 -179.963 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -150.15 0.01 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 179.981 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.7 p -114.52 -165.98 1.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.345 -1.091 . . . . 0.0 109.65 -179.875 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 1.8 m -87.8 96.67 10.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.304 -0.872 . . . . 0.0 109.715 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -107.48 168.72 9.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.574 -0.704 . . . . 0.0 109.223 -179.679 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t 51.42 20.24 0.96 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.03 -1.044 . . . . 0.0 109.013 -179.52 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.466 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 78.35 2.77 84.79 Favored Glycine 0 N--CA 1.487 2.088 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.855 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.552 ' CB ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mttm -140.0 151.67 45.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.931 -1.335 . . . . 0.0 110.379 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -54.82 175.1 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 119.91 -0.716 . . . . 0.0 109.41 179.816 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.412 0 O-C-N 119.989 -1.694 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.1 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.6 mmmt -114.07 171.43 7.61 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.168 -0.958 . . . . 0.0 110.372 -179.36 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -119.3 149.13 18.12 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.535 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.3 OUTLIER -44.79 158.4 0.06 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.132 -1.216 . . . . 0.0 109.952 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.04 -2.75 24.76 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.569 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.02 23.26 0.47 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.923 -1.34 . . . . 0.0 111.054 -179.82 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.577 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 1.4 ptmm? 46.93 175.64 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.537 -0.727 . . . . 0.0 109.66 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.577 ' CB ' ' O ' ' A' ' 7' ' ' LYS . 3.7 p 150.8 -172.73 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 CA-C-O 121.394 0.616 . . . . 0.0 109.754 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.458 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 13.9 t -93.35 -132.42 0.15 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.854 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' CYS . 6.7 ptt180 -120.66 -24.65 5.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.732 -1.23 . . . . 0.0 109.861 179.999 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.476 HD12 ' CG ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -108.86 8.96 26.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.195 -0.941 . . . . 0.0 109.51 -179.968 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.456 ' SD ' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -46.26 -49.83 16.8 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.28 -0.888 . . . . 0.0 109.345 179.971 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 54.11 29.22 9.99 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 109.554 179.965 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.456 ' OD2' ' SD ' ' A' ' 12' ' ' MET . 29.6 m-20 -100.98 -4.66 27.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.359 -0.838 . . . . 0.0 109.479 179.858 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -64.68 124.24 21.4 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.331 1.062 . . . . 0.0 109.301 179.572 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.69 -49.75 18.93 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.954 -179.889 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.9 72.72 1.5 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.14 -0.975 . . . . 0.0 109.506 -179.916 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.58 -165.77 34.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.5 p -129.99 -175.29 3.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.194 179.889 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -108.82 114.0 27.41 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.309 -0.87 . . . . 0.0 110.019 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' A' ' 22' ' ' SER . 24.3 mtp180 -145.21 149.34 34.76 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.735 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 80.07 -12.01 1.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.483 -0.761 . . . . 0.0 109.792 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.48 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . 118.53 -3.93 15.3 Favored Glycine 0 N--CA 1.488 2.157 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.286 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mtmt -146.54 164.55 32.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.732 -1.452 . . . . 0.0 111.417 -179.881 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.533 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -61.65 174.99 0.68 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.771 -179.546 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.535 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.307 -1.271 0 O-C-N 119.935 -1.728 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.1 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.324 0.583 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.702 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 1.7 mmmm -122.34 168.24 12.31 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.343 -0.848 . . . . 0.0 110.344 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.24 151.42 17.18 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.521 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -46.18 153.05 0.35 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.156 -1.203 . . . . 0.0 110.252 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.88 -18.74 5.74 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.702 ' HB1' ' HE3' ' A' ' 2' ' ' LYS . . . -78.23 46.45 0.61 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.761 -1.435 . . . . 0.0 110.703 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 52.53 164.15 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.221 -0.924 . . . . 0.0 110.824 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 5.0 p -161.17 170.53 20.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.527 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 6.7 t -98.71 -86.86 0.35 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.254 -0.904 . . . . 0.0 108.967 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HD2' ' O ' ' A' ' 9' ' ' SER . 13.1 mmm180 -156.72 -38.89 0.08 Allowed 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.15 42.14 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.288 -0.883 . . . . 0.0 109.325 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.527 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 79.9 mtp -83.38 -15.37 50.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.295 -0.878 . . . . 0.0 109.529 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 12' ' ' MET . 12.9 m-85 74.9 49.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.446 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -99.32 -38.93 8.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.304 -0.873 . . . . 0.0 109.163 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 8.1 m -54.96 122.84 11.77 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 122.381 1.086 . . . . 0.0 109.658 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -63.12 -37.95 89.25 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.661 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.46 ' O ' ' O ' ' A' ' 18' ' ' GLY . 41.7 p -104.53 -99.69 0.32 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.299 -0.876 . . . . 0.0 109.465 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -143.25 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.5 t -148.07 -162.88 1.64 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.25 -1.147 . . . . 0.0 109.532 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -46.74 132.2 11.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 110.225 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -146.18 128.86 16.18 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.41 -0.806 . . . . 0.0 109.141 179.09 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ARG . 46.7 t 44.15 25.97 0.13 Allowed 'General case' 0 C--N 1.296 -1.734 0 O-C-N 121.463 -0.773 . . . . 0.0 109.863 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.463 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 96.36 -26.44 21.44 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.5 mptp? -103.26 165.4 11.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.312 -1.111 . . . . 0.0 109.321 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.521 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.441 0 O-C-N 121.169 -0.957 . . . . 0.0 109.908 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.5 p . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.679 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.733 ' NZ ' ' HB1' ' A' ' 6' ' ' ALA . 5.6 mmmt -109.13 -141.34 0.38 Allowed 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.3 -0.875 . . . . 0.0 109.678 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 25' ' ' CYS . . . -178.87 163.0 30.42 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.457 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -47.84 149.07 1.39 Allowed 'General case' 0 C--N 1.307 -1.269 0 O-C-N 120.896 -1.356 . . . . 0.0 109.275 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.74 -39.99 3.1 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 108.454 -1.859 . . . . 0.0 108.454 -179.148 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.733 ' HB1' ' NZ ' ' A' ' 2' ' ' LYS . . . -67.32 71.41 0.11 Allowed 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.425 -1.044 . . . . 0.0 108.495 179.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.633 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.92 153.13 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.763 0.792 . . . . 0.0 110.697 -179.211 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -131.94 -174.81 3.53 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -179.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 4.0 m -90.33 -46.84 8.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.659 -1.276 . . . . 0.0 108.701 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 9' ' ' SER . 1.9 mmm180 179.2 -87.55 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.614 -0.678 . . . . 0.0 109.746 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.95 21.32 7.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.046 -1.034 . . . . 0.0 109.827 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.46 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -56.35 -25.3 48.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.244 -0.91 . . . . 0.0 109.184 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 48.07 64.9 1.46 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.359 -0.838 . . . . 0.0 109.788 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.507 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 1.1 m-20 -119.82 -24.77 6.05 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.18 -0.95 . . . . 0.0 109.541 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 4.1 m -53.45 120.79 6.54 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.42 1.105 . . . . 0.0 109.443 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -47.03 -35.14 6.42 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.694 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 38.7 p -85.89 -137.07 0.07 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -52.99 -105.06 0.01 OUTLIER Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.1 p -151.08 -158.26 0.9 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.038 -1.272 . . . . 0.0 109.785 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 7.2 m -68.03 137.27 54.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.368 -0.833 . . . . 0.0 109.698 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -125.92 125.08 42.18 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.232 -0.918 . . . . 0.0 109.091 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.8 p 50.52 22.42 1.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.384 -0.823 . . . . 0.0 109.335 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.98 -19.76 53.0 Favored Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.633 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -100.47 140.96 33.98 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.378 -1.072 . . . . 0.0 109.409 179.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.498 ' HB3' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 O-C-N 121.02 -1.05 . . . . 0.0 108.916 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.253 0.549 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 20.6 mmtm -112.98 165.06 12.7 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.236 -0.915 . . . . 0.0 110.314 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.56 163.33 19.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -52.02 155.43 1.86 Allowed 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.175 -1.191 . . . . 0.0 110.152 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 59.62 8.24 7.13 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 18.34 0.88 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.852 -1.381 . . . . 0.0 110.587 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.04 154.13 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.189 -0.944 . . . . 0.0 110.713 -179.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -157.06 178.8 9.94 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.775 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 8.9 t -91.74 -45.43 8.43 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.831 -1.168 . . . . 0.0 108.646 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.434 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 176.91 -83.42 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.866 0 O-C-N 121.753 -0.592 . . . . 0.0 109.771 179.126 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.99 24.17 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.272 -0.893 . . . . 0.0 109.756 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 74.5 mmm -61.33 -16.53 46.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.051 -1.031 . . . . 0.0 109.256 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 58.25 60.96 2.45 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 0.0 109.572 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -106.81 -26.05 11.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.406 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -55.41 122.18 10.62 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 122.349 1.071 . . . . 0.0 109.562 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -53.68 -43.15 68.64 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.846 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.709 ' O ' HG23 ' A' ' 17' ' ' THR . 6.7 t -139.86 88.08 2.21 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 109.521 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.67 -162.53 26.61 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.3 p -132.7 -165.51 1.61 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.257 -1.143 . . . . 0.0 109.371 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 23.5 m -92.03 136.51 33.11 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.186 -0.946 . . . . 0.0 109.697 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -125.38 106.94 10.2 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.19 -0.944 . . . . 0.0 108.813 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.74 12.38 7.59 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 121.592 -0.693 . . . . 0.0 109.336 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 7' ' ' LYS . . . 112.26 -16.5 24.72 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.9 mtpt -94.19 145.8 24.45 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.615 -0.932 . . . . 0.0 109.356 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.489 0 O-C-N 121.113 -0.992 . . . . 0.0 109.454 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.421 0.629 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.457 ' CD ' ' N ' ' A' ' 2' ' ' LYS . 10.1 mptt -97.67 167.42 10.97 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.329 -0.857 . . . . 0.0 109.785 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.19 170.69 17.13 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.341 -1.904 . . . . 0.0 108.341 179.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.445 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -49.38 147.27 3.34 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.738 -1.448 . . . . 0.0 108.896 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.23 -31.7 6.17 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.03 75.48 0.93 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.587 -0.949 . . . . 0.0 108.465 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.77 152.46 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.219 0.533 . . . . 0.0 110.58 -179.448 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.603 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.3 -177.6 4.79 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.603 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m -91.24 -62.5 1.43 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.791 -1.193 . . . . 0.0 109.074 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.497 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 166.01 102.4 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.497 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.18 15.64 1.37 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.599 -0.688 . . . . 0.0 109.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.439 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 3.9 mmm -69.71 -18.99 63.57 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.281 -0.887 . . . . 0.0 109.367 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.439 ' HB2' ' O ' ' A' ' 12' ' ' MET . 43.8 m-85 60.53 66.96 0.87 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.318 -0.864 . . . . 0.0 109.169 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -123.3 -22.44 5.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.356 -0.84 . . . . 0.0 109.767 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -64.27 119.93 11.22 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 122.483 1.135 . . . . 0.0 110.315 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.87 -38.37 55.79 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.42 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.48 102.71 4.53 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.389 -0.819 . . . . 0.0 109.397 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.99 -166.68 12.77 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.3 p -128.85 173.18 10.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.129 -1.219 . . . . 0.0 109.435 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.5 m -60.64 102.68 0.2 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.274 -0.891 . . . . 0.0 109.492 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.545 ' N ' ' O ' ' A' ' 24' ' ' LYS . 34.4 ttp180 -99.9 139.88 34.93 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.155 -0.965 . . . . 0.0 109.118 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 18.75 6.23 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.081 -1.012 . . . . 0.0 109.353 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.38 -11.9 70.81 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.9 mtpp -119.71 170.04 9.56 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.084 -1.245 . . . . 0.0 109.569 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.445 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m . . . . . 0 C--N 1.301 -1.503 0 O-C-N 121.187 -0.946 . . . . 0.0 109.472 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.7 p . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.402 0.62 . . . . 0.0 109.598 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.569 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 6.5 mmtp -119.33 -179.98 4.02 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.495 -0.753 . . . . 0.0 110.108 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -123.74 163.49 17.31 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -44.81 158.88 0.05 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.216 -1.167 . . . . 0.0 109.308 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 90.08 -34.57 4.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 108.869 -1.692 . . . . 0.0 108.869 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.467 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.5 72.57 0.99 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.381 -1.07 . . . . 0.0 108.449 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -35.52 156.18 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.179 0.514 . . . . 0.0 110.406 -179.159 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.26 -177.32 4.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.025 -1.047 . . . . 0.0 108.448 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.3 -62.51 1.42 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.898 -1.126 . . . . 0.0 109.256 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.52 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 167.9 96.94 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 O-C-N 121.564 -0.71 . . . . 0.0 109.923 179.418 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.84 54.56 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.579 -0.701 . . . . 0.0 109.547 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.402 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -108.31 -18.8 13.67 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' MET . 88.9 m-85 60.46 80.94 0.19 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 2' ' ' LYS . 3.6 m-20 -144.93 -37.8 0.28 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.248 -0.908 . . . . 0.0 109.347 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -60.37 126.13 26.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.42 1.105 . . . . 0.0 108.661 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -59.43 -36.51 76.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 46.5 p -108.1 135.91 48.66 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.057 -1.027 . . . . 0.0 109.513 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 51.12 -150.4 6.61 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.63 -164.13 1.45 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.393 -1.063 . . . . 0.0 109.469 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -61.28 107.72 0.81 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.465 -0.772 . . . . 0.0 109.854 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -97.17 137.99 35.36 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.004 -1.06 . . . . 0.0 109.05 179.313 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.6 20.77 1.14 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.363 -0.836 . . . . 0.0 109.275 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.7 -16.73 60.1 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 61.2 mttt -106.06 174.08 6.04 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.11 -1.229 . . . . 0.0 110.157 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 O-C-N 120.92 -1.112 . . . . 0.0 108.819 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.639 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 7.0 mmtt -134.04 168.48 18.73 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.123 -0.986 . . . . 0.0 110.377 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -100.79 170.05 21.63 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -60.8 159.81 10.5 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.157 -1.202 . . . . 0.0 109.918 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 60.22 8.39 8.77 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -80.37 15.96 1.45 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.914 -1.345 . . . . 0.0 110.412 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.89 153.85 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.862 0.839 . . . . 0.0 110.675 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.609 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -159.64 -177.94 6.74 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.41 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.609 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.2 -56.0 3.39 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 120.875 -1.141 . . . . 0.0 108.563 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CB ' ' O ' ' A' ' 9' ' ' SER . 1.1 ptm180 159.33 101.15 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 121.306 0.574 . . . . 0.0 109.655 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.55 51.96 0.46 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.679 -0.638 . . . . 0.0 109.799 179.668 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.503 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 1.9 mtp -106.28 -7.56 17.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.373 -0.83 . . . . 0.0 109.275 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 54.19 51.6 14.16 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.457 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.503 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 9.3 m-20 -104.62 -14.46 15.61 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.478 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.9 m -67.18 124.53 23.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 122.496 1.141 . . . . 0.0 109.706 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -59.84 -9.91 3.39 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.489 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.3 p -133.14 1.6 3.53 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.713 -1.242 . . . . 0.0 111.093 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -178.1 -145.2 5.86 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.159 -1.496 . . . . 0.0 110.41 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -119.74 -171.02 2.05 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.392 -1.064 . . . . 0.0 109.326 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -70.29 142.14 52.29 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 110.172 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.24 125.39 43.51 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 31.0 p 54.94 17.94 2.03 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.553 -0.717 . . . . 0.0 109.465 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.94 -45.71 1.28 Allowed Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.902 -1.279 . . . . 0.0 109.902 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.5 mttt -93.52 162.14 14.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.281 -1.129 . . . . 0.0 109.758 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.641 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 3.9 mmtm -127.29 174.73 8.72 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -120.04 168.49 13.74 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -48.49 154.45 0.64 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.882 -1.364 . . . . 0.0 109.515 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.78 -40.04 2.84 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.536 -2.226 . . . . 0.0 107.536 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.19 78.61 0.97 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.751 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -35.86 157.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.767 0.794 . . . . 0.0 110.676 -178.671 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -132.73 -177.55 4.54 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -179.31 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.595 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.42 -45.75 8.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.708 -1.245 . . . . 0.0 109.261 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 31.1 ttt180 -175.08 -85.22 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.477 -0.764 . . . . 0.0 109.899 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.461 HD23 ' CZ ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -122.68 33.81 5.32 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.003 -1.061 . . . . 0.0 109.854 -179.671 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.2 mtt -67.8 -8.82 39.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.223 -0.923 . . . . 0.0 109.152 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 12' ' ' MET . 23.7 m-85 62.38 58.68 1.68 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.11 -41.21 5.89 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.216 -0.928 . . . . 0.0 109.315 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -55.3 123.77 14.89 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.439 1.114 . . . . 0.0 109.017 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.97 -28.79 54.24 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.065 -179.721 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 p -139.22 158.95 43.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.191 -0.943 . . . . 0.0 109.545 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 61.39 -146.81 48.11 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.4 p -150.85 171.12 17.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.253 -1.145 . . . . 0.0 109.602 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 20.9 m -56.5 114.9 2.22 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.377 -0.827 . . . . 0.0 109.553 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.0 mtt180 -119.03 141.82 48.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.124 -0.985 . . . . 0.0 109.247 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 11.2 t 51.4 21.98 1.34 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.166 -0.958 . . . . 0.0 109.068 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.63 -10.77 58.65 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.751 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.1 mttp -106.66 152.57 23.59 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.13 -1.217 . . . . 0.0 109.665 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.471 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--N 1.301 -1.542 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.596 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.284 0.564 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.628 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 4.4 mmtp -119.07 169.89 9.53 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.178 -0.951 . . . . 0.0 110.041 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.48 177.47 18.48 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.873 -1.691 . . . . 0.0 108.873 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.6 pttt -59.53 153.63 19.2 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 120.89 -1.359 . . . . 0.0 109.447 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.66 -32.47 4.51 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -67.19 67.44 0.07 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.351 -1.087 . . . . 0.0 109.356 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -20.8 136.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.768 0.794 . . . . 0.0 111.831 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.2 -178.28 3.63 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.789 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.71 31.55 1.19 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 0.0 109.79 -178.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.7 ttm180 81.19 -43.59 0.19 Allowed 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.981 -0.449 . . . . 0.0 110.262 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -149.95 81.61 1.38 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.819 -1.176 . . . . 0.0 110.72 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.462 ' HG3' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -128.78 -9.19 4.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.101 -1.0 . . . . 0.0 109.613 178.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 58.22 59.55 3.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.036 -1.04 . . . . 0.0 109.85 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.01 -25.64 7.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.921 . . . . 0.0 109.181 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.4 m -56.75 123.75 16.05 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.393 1.092 . . . . 0.0 109.706 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.01 -19.89 34.58 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.236 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.4 p -93.52 -133.47 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.49 -0.756 . . . . 0.0 109.262 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.92 -95.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -147.54 -171.61 3.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.229 -1.16 . . . . 0.0 109.594 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.9 m -62.56 142.58 57.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.71 134.5 45.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.165 -0.959 . . . . 0.0 108.982 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.6 p 47.93 22.72 0.4 Allowed 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.504 -0.748 . . . . 0.0 109.415 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.25 -32.25 6.62 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.764 -1.334 . . . . 0.0 109.764 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.4 mttt -93.67 148.5 22.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.244 -1.151 . . . . 0.0 109.743 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.471 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.087 -1.008 . . . . 0.0 109.138 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -110.19 165.01 12.09 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.238 -0.914 . . . . 0.0 110.233 -179.643 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.448 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -105.49 164.96 14.02 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -51.53 151.43 3.16 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.073 -1.251 . . . . 0.0 110.012 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.89 4.76 22.14 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.89 17.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.957 -1.32 . . . . 0.0 110.618 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.44 149.06 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.191 -0.943 . . . . 0.0 111.15 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -155.98 176.5 12.56 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.791 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.17 -53.7 4.13 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.033 -1.042 . . . . 0.0 108.712 179.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.516 ' CB ' ' O ' ' A' ' 9' ' ' SER . 7.6 ptt180 161.14 94.08 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 66.63 55.15 0.8 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.55 -0.719 . . . . 0.0 109.327 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.434 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -99.14 -9.48 23.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.438 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 12' ' ' MET . 14.2 m-85 69.02 31.56 4.08 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.17 -0.956 . . . . 0.0 109.607 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -97.9 -35.89 10.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.356 -0.84 . . . . 0.0 108.949 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -54.89 123.49 13.61 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 122.475 1.131 . . . . 0.0 109.989 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -62.61 -13.15 28.23 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.524 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.431 ' O ' ' C ' ' A' ' 18' ' ' GLY . 13.3 t -144.85 155.02 43.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 109.912 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.431 ' C ' ' O ' ' A' ' 17' ' ' THR . . . 42.11 -145.96 0.72 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.7 p -133.15 -166.53 1.78 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -1.101 . . . . 0.0 109.375 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.3 m -70.91 129.42 39.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.218 -0.926 . . . . 0.0 109.544 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -114.17 125.17 53.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.284 -0.885 . . . . 0.0 109.182 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.77 15.54 2.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.349 -0.844 . . . . 0.0 109.848 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.06 -34.78 5.23 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -93.68 165.84 12.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -1.188 . . . . 0.0 109.622 -179.681 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.487 1.401 0 O-C-N 121.151 -0.968 . . . . 0.0 109.649 -179.853 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 7.9 p . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.573 ' HD2' ' HB2' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -146.62 167.29 24.13 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.263 -0.898 . . . . 0.0 110.485 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.21 -172.15 28.54 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 108.599 -1.8 . . . . 0.0 108.599 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.1 160.07 6.63 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.858 -1.377 . . . . 0.0 109.312 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.41 -13.99 48.3 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HB2' ' HD2' ' A' ' 2' ' ' LYS . . . -73.26 60.83 0.61 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -1.09 . . . . 0.0 108.989 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.564 ' C ' ' O ' ' A' ' 6' ' ' ALA . 11.4 mtmt -18.36 131.67 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.836 0.827 . . . . 0.0 111.803 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.579 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.85 -179.2 3.94 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -179.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.579 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.4 -58.52 2.41 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.875 -1.141 . . . . 0.0 108.778 179.562 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.676 ' O ' HD12 ' A' ' 11' ' ' LEU . 10.2 ptm180 177.05 24.91 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.77 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 160.98 -18.35 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.05 -1.031 . . . . 0.0 110.624 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.464 ' C ' ' O ' ' A' ' 11' ' ' LEU . 1.1 mmt -39.03 -29.87 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.434 -0.791 . . . . 0.0 109.748 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.479 ' N ' ' O ' ' A' ' 11' ' ' LEU . 3.3 m-85 64.41 62.49 0.81 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.376 -0.828 . . . . 0.0 110.34 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -99.38 -15.16 18.87 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.089 -1.007 . . . . 0.0 108.992 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.8 m -64.7 125.04 23.51 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 122.252 1.025 . . . . 0.0 108.798 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -50.7 -52.73 37.38 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.195 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 17' ' ' THR . 4.8 t -135.61 59.31 1.72 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.001 -1.062 . . . . 0.0 109.642 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.67 -173.11 41.1 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.5 m -125.52 -169.13 1.94 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -1.185 . . . . 0.0 109.556 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.2 m -86.79 111.23 20.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.622 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -114.59 129.37 56.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.143 -0.973 . . . . 0.0 109.119 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.69 9.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.083 -1.01 . . . . 0.0 109.103 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.92 -9.22 69.82 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mttt -109.81 146.24 35.37 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.366 -1.079 . . . . 0.0 109.697 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.302 -1.496 0 O-C-N 121.253 -0.904 . . . . 0.0 109.145 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.7 p . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.141 0.496 . . . . 0.0 109.662 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 12.0 mmtm -116.08 163.07 16.48 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.328 -0.858 . . . . 0.0 110.187 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.26 167.06 22.35 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -61.05 159.54 11.49 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.134 -1.215 . . . . 0.0 110.172 -179.436 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.3 -0.64 15.92 Favored Glycine 0 N--CA 1.494 2.519 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.91 18.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.837 -1.39 . . . . 0.0 111.024 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.27 146.92 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.015 0.912 . . . . 0.0 111.076 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.566 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.6 p 172.48 178.11 0.08 Allowed 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.909 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 40.4 t -93.6 151.55 19.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.195 -0.941 . . . . 0.0 109.201 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 9' ' ' SER . 6.0 mtm180 -39.64 -37.88 0.56 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.47 ' O ' ' C ' ' A' ' 12' ' ' MET . 2.6 mp -85.88 -111.34 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.47 ' C ' ' O ' ' A' ' 11' ' ' LEU . 33.3 mtt 39.5 75.33 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.191 -0.943 . . . . 0.0 109.636 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -72.56 50.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.164 -0.96 . . . . 0.0 109.711 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.4 ' O ' ' C ' ' A' ' 15' ' ' CYS . 72.1 m-20 -95.02 -29.75 14.45 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.469 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 40.1 m -44.42 126.19 5.16 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 122.217 1.008 . . . . 0.0 109.667 179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -64.91 -6.17 7.76 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.666 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 p -138.65 25.54 2.59 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.762 -1.211 . . . . 0.0 110.742 -179.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.469 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . 145.45 -122.61 1.73 Allowed Glycine 0 N--CA 1.492 2.423 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.09 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 14.3 t -147.37 -163.71 1.83 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.335 -1.097 . . . . 0.0 109.321 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.534 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -78.29 132.85 37.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.18 -0.95 . . . . 0.0 111.381 -179.767 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.538 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.1 ttm180 -119.29 114.37 22.28 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 2.0 t 79.52 -23.7 0.23 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.705 -0.622 . . . . 0.0 110.365 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.439 ' C ' ' SG ' ' A' ' 20' ' ' CYS . . . 150.22 -14.29 0.97 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 110.037 -1.225 . . . . 0.0 110.037 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 45.9 mttt -128.46 156.64 42.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.905 -1.35 . . . . 0.0 110.494 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.566 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m . . . . . 0 N--CA 1.49 1.55 0 C-N-CA 120.064 -0.654 . . . . 0.0 109.817 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 37.6 mmtt -125.18 172.5 9.47 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.208 -0.932 . . . . 0.0 110.402 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.91 172.74 14.37 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.477 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.1 pttm -58.78 155.62 12.59 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 120.885 -1.362 . . . . 0.0 109.516 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.51 -30.67 7.08 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.495 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.11 75.46 3.68 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.653 -0.91 . . . . 0.0 108.699 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.67 150.23 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.528 0.68 . . . . 0.0 110.48 -179.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -128.66 -178.15 4.48 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.368 -0.832 . . . . 0.0 109.124 -179.531 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.527 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.0 35.39 0.98 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.218 -0.926 . . . . 0.0 109.848 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 55.33 93.17 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.151 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.273 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.31 62.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.516 0.674 . . . . 0.0 109.717 -179.609 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.483 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 2.6 mtp -117.9 -21.16 8.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.351 -0.843 . . . . 0.0 108.971 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.4 m-30 60.73 48.04 7.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 109.645 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 30.9 m-20 -111.46 -31.18 7.11 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.232 -0.917 . . . . 0.0 109.51 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.0 m -50.72 122.39 7.22 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 122.311 1.053 . . . . 0.0 108.923 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.55 -26.89 9.41 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.356 -179.463 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -132.52 113.24 12.86 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.232 -0.918 . . . . 0.0 109.805 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 -140.13 17.2 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.6 p -140.92 -169.46 2.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -1.108 . . . . 0.0 109.248 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 m -60.43 153.43 23.06 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.167 -0.958 . . . . 0.0 109.358 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -122.72 108.74 13.4 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.358 -0.839 . . . . 0.0 109.161 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 44.46 26.08 0.16 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.694 -0.629 . . . . 0.0 109.395 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.463 ' HA3' ' NH2' ' A' ' 10' ' ' ARG . . . 111.5 -27.69 10.33 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.89 -1.284 . . . . 0.0 109.89 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.0 mttt -102.79 135.15 44.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.208 -1.172 . . . . 0.0 109.837 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.477 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.211 -0.93 . . . . 0.0 108.777 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 121.241 0.543 . . . . 0.0 109.555 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.684 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 3.5 mmmt -113.57 169.75 8.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.312 -0.868 . . . . 0.0 109.744 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.79 172.35 18.15 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.548 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.0 OUTLIER -62.09 147.51 47.18 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.149 -1.207 . . . . 0.0 108.775 179.57 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.548 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 63.73 6.36 16.89 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.684 ' HB1' ' HE3' ' A' ' 2' ' ' LYS . . . -79.54 19.26 0.64 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.004 -1.291 . . . . 0.0 110.816 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.55 149.46 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.167 -0.958 . . . . 0.0 111.427 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.612 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -152.64 -178.05 6.62 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.612 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.14 -69.36 0.73 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 120.699 -1.251 . . . . 0.0 108.279 179.322 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 166.19 108.32 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.68 44.95 0.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.515 -0.741 . . . . 0.0 109.58 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.485 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 23.3 mmt -109.95 -23.3 11.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.314 -0.866 . . . . 0.0 109.236 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 62.74 52.34 2.81 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.367 -0.833 . . . . 0.0 109.796 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -101.99 -21.15 14.55 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.241 -0.912 . . . . 0.0 109.086 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.1 m -63.14 123.06 17.66 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 122.589 1.185 . . . . 0.0 109.811 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.04 -22.01 2.13 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.281 179.547 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.44 144.7 34.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.49 -0.756 . . . . 0.0 109.324 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.33 -146.93 45.68 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.5 m -144.46 -163.92 1.79 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.128 -1.219 . . . . 0.0 109.67 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 m -74.88 153.29 38.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.16 -0.962 . . . . 0.0 109.774 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 24' ' ' LYS . 5.1 ttt180 -145.77 116.08 7.51 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.458 ' HB2' ' CE ' ' A' ' 24' ' ' LYS . 34.8 m 61.42 15.54 6.7 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.457 -0.777 . . . . 0.0 109.565 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 103.01 -6.24 51.13 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.6 OUTLIER -110.7 161.67 15.52 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.284 -1.127 . . . . 0.0 109.64 -179.869 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.212 -0.93 . . . . 0.0 109.619 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.1 p . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.335 0.588 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 25.4 mmtp -111.77 168.29 9.69 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.809 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -114.29 167.83 12.42 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.606 ' NZ ' HG21 ' A' ' 17' ' ' THR . 0.8 OUTLIER -46.91 165.44 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.306 -1.114 . . . . 0.0 110.074 -179.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 54.52 18.27 10.12 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.14 -1.584 . . . . 0.0 109.14 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.809 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -78.64 15.86 0.96 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.33 -1.1 . . . . 0.0 111.327 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.512 ' C ' ' O ' ' A' ' 6' ' ' ALA . 7.4 ptmm? 31.66 44.66 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 122.018 0.913 . . . . 0.0 109.68 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.597 ' N ' ' O ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -49.21 178.31 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 -178.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.555 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.25 36.4 0.99 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.042 -1.036 . . . . 0.0 109.57 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.638 ' HG2' HD23 ' A' ' 11' ' ' LEU . 2.0 ttp180 79.02 -80.94 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.978 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.638 HD23 ' HG2' ' A' ' 10' ' ' ARG . 2.0 mm? -115.53 79.62 1.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.001 -1.062 . . . . 0.0 109.487 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.463 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 2.8 mtt -122.53 -9.26 8.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 109.487 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 58.48 59.77 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.248 -0.907 . . . . 0.0 109.684 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -122.12 -21.21 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.679 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 19' ' ' SER . 57.5 m -58.32 119.63 7.27 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 122.483 1.135 . . . . 0.0 110.167 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.35 -18.4 4.05 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.707 179.402 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.606 HG21 ' NZ ' ' A' ' 4' ' ' LYS . 2.4 t -114.98 -121.28 0.3 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.942 . . . . 0.0 109.833 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.464 ' N ' HG23 ' A' ' 17' ' ' THR . . . -61.2 -131.37 0.01 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.446 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.8 t -115.05 -149.36 0.44 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -1.182 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 25.9 m -96.7 137.19 36.15 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 109.803 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 -107.08 117.02 32.97 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 50.11 23.04 1.04 Allowed 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.324 -0.86 . . . . 0.0 108.993 -179.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.597 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.76 -28.63 14.58 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.339 -1.505 . . . . 0.0 109.339 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 4.0 mttm -92.34 134.25 35.09 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.9 -1.353 . . . . 0.0 109.0 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 1.7 m . . . . . 0 C--N 1.291 -1.946 0 O-C-N 121.736 -0.603 . . . . 0.0 109.687 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.357 0.599 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.7 mmtt -126.9 172.93 10.0 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.261 -0.899 . . . . 0.0 110.443 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -113.78 -175.5 19.05 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 108.712 -1.755 . . . . 0.0 108.712 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.3 OUTLIER -62.59 145.18 55.08 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.775 -1.426 . . . . 0.0 108.108 179.411 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.539 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 106.22 -32.26 7.52 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 108.147 -1.981 . . . . 0.0 108.147 -178.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -72.24 76.14 0.99 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.5 153.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.463 0.649 . . . . 0.0 110.691 -179.263 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.578 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -137.14 -175.12 3.94 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.578 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.2 t -90.28 -44.11 9.93 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.457 -1.402 . . . . 0.0 109.771 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 9' ' ' SER . 3.0 ptm180 175.97 -34.76 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.82 0 O-C-N 121.332 -0.855 . . . . 0.0 109.981 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.81 23.4 0.77 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.2 mmt -60.27 -16.05 30.58 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.121 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 50.21 47.36 23.77 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.273 -0.892 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -94.67 -19.62 20.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 109.004 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 2.8 m -63.88 124.63 22.02 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.376 1.084 . . . . 0.0 108.522 179.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -50.65 -52.27 41.3 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.829 -179.21 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.7 p -115.97 -61.81 1.68 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.091 -1.006 . . . . 0.0 110.216 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.527 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -62.37 -162.44 0.27 Allowed Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.95 173.66 11.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.395 -1.062 . . . . 0.0 108.863 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 m -58.62 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.04 -1.037 . . . . 0.0 109.363 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 24' ' ' LYS . 12.0 ttm180 -96.95 122.06 39.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.098 -1.001 . . . . 0.0 109.404 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 t 58.6 30.69 20.19 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.416 -0.803 . . . . 0.0 109.485 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.16 -10.5 63.24 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.5 mtmt -109.45 141.51 41.77 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.283 -1.128 . . . . 0.0 109.546 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 109.295 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.8 p . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -120.76 176.58 5.46 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.1 -1.0 . . . . 0.0 110.294 -179.595 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -116.15 167.92 12.58 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.44 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -60.75 153.29 24.64 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.022 -1.281 . . . . 0.0 109.514 -179.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.409 ' HA2' ' HD2' ' A' ' 24' ' ' LYS . . . 62.67 -0.24 2.33 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.19 26.59 0.44 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.641 -1.505 . . . . 0.0 110.711 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 55.52 159.7 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 O-C-N 120.932 -1.105 . . . . 0.0 110.506 -179.765 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -162.88 -179.17 6.59 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 6.2 m -90.95 -50.22 5.99 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.764 -1.21 . . . . 0.0 108.808 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 175.26 -76.9 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.775 -0.578 . . . . 0.0 109.689 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.05 31.48 6.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.116 -0.99 . . . . 0.0 109.607 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.424 ' O ' ' C ' ' A' ' 13' ' ' TYR . 1.7 mmm -74.93 -4.98 41.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.26 -0.9 . . . . 0.0 109.44 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.424 ' C ' ' O ' ' A' ' 12' ' ' MET . 6.3 m-85 43.31 54.11 5.25 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.257 -0.902 . . . . 0.0 109.575 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.471 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -95.5 -20.55 18.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.228 -0.92 . . . . 0.0 109.129 179.766 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.4 m -56.89 121.73 10.59 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.588 1.185 . . . . 0.0 109.511 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.29 -36.15 41.08 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.011 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.524 ' O ' HG23 ' A' ' 17' ' ' THR . 3.0 t -146.25 78.43 1.52 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.167 -0.958 . . . . 0.0 109.757 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 146.94 -170.94 27.78 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.691 -1.364 . . . . 0.0 109.691 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.0 OUTLIER -121.91 -162.29 0.98 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.258 -1.142 . . . . 0.0 109.074 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 38.9 m -97.5 149.4 22.22 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.872 -1.142 . . . . 0.0 110.144 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 24' ' ' LYS . 31.7 mtt180 -146.31 136.76 23.94 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 50.08 26.14 1.98 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.183 -0.948 . . . . 0.0 109.244 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.1 31.16 39.63 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.7 mtmt -145.33 157.81 43.96 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.295 -1.12 . . . . 0.0 110.067 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.784 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.7 p . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.352 0.596 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.532 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 1.9 mptt -94.58 160.22 14.73 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.39 -0.819 . . . . 0.0 109.586 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.659 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -112.07 169.55 13.17 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.536 ' HA ' ' CB ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -44.91 166.83 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.288 -1.125 . . . . 0.0 109.238 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 58.94 15.27 27.52 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.659 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -77.98 14.0 1.25 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.26 -1.141 . . . . 0.0 111.135 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER 30.19 45.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 121.703 0.764 . . . . 0.0 110.4 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -54.47 -178.68 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -179.558 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.597 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.6 -45.99 8.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.716 -1.24 . . . . 0.0 109.334 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 9' ' ' SER . 3.7 mtt180 178.63 -94.57 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.56 -0.713 . . . . 0.0 109.747 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.409 ' HA ' HD22 ' A' ' 11' ' ' LEU . 2.8 mm? -90.58 43.08 1.13 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.112 -0.993 . . . . 0.0 109.705 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.447 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 2.9 mmt -75.75 -19.04 59.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.237 -0.914 . . . . 0.0 109.389 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 49.07 41.82 19.99 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.17 -0.956 . . . . 0.0 109.667 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.502 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 58.8 m-20 -102.69 -20.57 14.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 65.1 m -50.1 117.18 2.19 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 122.326 1.06 . . . . 0.0 110.332 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -48.91 -27.65 3.24 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.419 179.203 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.501 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.1 t -98.88 -118.55 0.14 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.476 -0.765 . . . . 0.0 109.742 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.501 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -71.65 -114.09 0.05 OUTLIER Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 p -128.35 -168.12 1.86 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.333 -1.098 . . . . 0.0 109.735 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 38.3 m -69.32 150.6 47.18 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.339 -0.851 . . . . 0.0 109.991 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -128.54 123.59 33.87 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER 45.1 26.18 0.22 Allowed 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.576 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 99.97 -36.67 3.95 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.485 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 3.6 mtmm -92.01 141.27 28.8 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.224 -1.162 . . . . 0.0 109.104 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.536 ' CB ' ' HA ' ' A' ' 4' ' ' LYS . 1.7 m . . . . . 0 C--N 1.298 -1.647 0 O-C-N 121.577 -0.702 . . . . 0.0 109.609 -179.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.3 p . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.295 0.569 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtp -116.84 174.38 6.12 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.19 -0.944 . . . . 0.0 110.004 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.432 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -118.71 177.71 16.5 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.4 mtpt -60.48 147.61 40.61 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.08 -1.247 . . . . 0.0 110.063 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.93 -14.7 51.79 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.98 64.09 2.41 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.435 -1.038 . . . . 0.0 109.25 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.561 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.5 OUTLIER -11.49 128.33 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.802 0.81 . . . . 0.0 112.168 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.589 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.02 -178.51 3.52 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -179.685 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.83 -66.28 0.94 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 120.98 -1.075 . . . . 0.0 108.601 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.543 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ptt180 168.82 108.9 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 7.2 mt 70.19 12.5 7.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.871 -0.518 . . . . 0.0 110.401 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.459 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 8.6 mtt -67.24 -29.61 69.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.097 -1.002 . . . . 0.0 109.117 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.5 m-85 64.74 65.95 0.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.798 . . . . 0.0 110.223 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -118.62 -19.1 8.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -0.85 . . . . 0.0 109.134 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.5 m -60.59 123.95 18.92 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.495 1.14 . . . . 0.0 109.673 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -55.84 -41.55 74.46 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.702 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.8 89.41 2.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 109.528 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.03 -168.61 22.89 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -128.61 -167.37 1.76 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.138 -1.213 . . . . 0.0 109.682 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 35.2 m -84.5 96.37 9.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.189 -0.945 . . . . 0.0 109.682 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' N ' ' O ' ' A' ' 24' ' ' LYS . 11.1 ptp180 -102.84 137.19 41.38 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.95 -1.094 . . . . 0.0 108.913 179.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.85 19.04 10.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.154 -0.966 . . . . 0.0 109.116 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.18 -9.12 74.02 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 28.4 mtmt -111.74 173.21 6.46 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.171 -1.194 . . . . 0.0 109.764 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.8 OUTLIER . . . . . 0 C--N 1.298 -1.639 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.334 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.346 0.594 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.535 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 7.1 mmtm -131.08 169.11 16.32 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.183 -0.948 . . . . 0.0 110.437 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.84 166.46 14.8 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.463 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.5 pttm -50.21 154.85 1.09 Allowed 'General case' 0 C--N 1.306 -1.315 0 O-C-N 120.972 -1.31 . . . . 0.0 109.212 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.97 -20.31 36.94 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.535 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -77.91 68.74 4.03 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.376 -1.073 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 8.5 mttt -20.17 138.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.898 0.856 . . . . 0.0 112.38 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.605 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.39 -178.28 4.7 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 179.856 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.605 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 28.4 t -90.3 -73.35 0.53 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.737 -1.227 . . . . 0.0 108.13 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.823 ' O ' HD12 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -167.82 17.88 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.536 -0.727 . . . . 0.0 110.459 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.823 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 157.7 36.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.418 -0.801 . . . . 0.0 109.494 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.414 ' O ' ' C ' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -82.54 8.68 11.08 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 109.518 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' HD23 ' A' ' 11' ' ' LEU . 8.0 m-85 44.28 49.51 7.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.532 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.497 ' O ' ' N ' ' A' ' 2' ' ' LYS . 6.0 p-10 -103.55 -35.3 8.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.211 -0.931 . . . . 0.0 109.534 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 4.0 m -61.11 125.14 22.65 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 122.349 1.071 . . . . 0.0 110.004 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -65.47 -33.19 75.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.884 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 1.3 t -117.94 -115.48 0.33 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -42.82 165.5 0.02 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.4 t -91.56 -174.46 3.89 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.308 -1.113 . . . . 0.0 109.555 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.2 m -61.18 105.18 0.46 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.324 -0.86 . . . . 0.0 109.46 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . 2.5 tmt_? -96.21 135.76 37.59 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.057 -1.027 . . . . 0.0 109.06 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.453 ' OG ' ' HD3' ' A' ' 21' ' ' ARG . 20.2 m 47.24 23.42 0.32 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.162 -0.961 . . . . 0.0 109.483 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.55 -20.26 49.35 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.596 -1.401 . . . . 0.0 109.596 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.8 mtmp? -101.72 148.5 25.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -1.146 . . . . 0.0 109.716 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.463 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.1 m . . . . . 0 N--CA 1.491 1.591 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.4 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.261 0.553 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 28.5 mmtm -112.55 164.77 12.91 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -104.74 167.34 15.29 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.415 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.2 tttp -52.0 153.03 2.81 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.141 -1.211 . . . . 0.0 110.086 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.5 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 60.74 3.92 3.7 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.54 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.94 20.66 0.76 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.805 -1.409 . . . . 0.0 110.903 -179.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.54 ' O ' ' O ' ' A' ' 6' ' ' ALA . 13.4 mtpt 52.66 123.34 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 122.688 1.232 . . . . 0.0 111.379 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.08 -178.47 3.51 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.121 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.565 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -92.26 35.68 1.0 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.054 -1.029 . . . . 0.0 109.531 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.503 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 78.14 -54.83 0.5 Allowed 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.018 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.93 43.21 0.97 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.088 -1.007 . . . . 0.0 109.711 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.549 ' HB2' ' HB2' ' A' ' 9' ' ' SER . 0.1 OUTLIER -93.54 -3.89 52.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.0 109.555 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 55.89 55.86 6.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.249 -0.907 . . . . 0.0 109.766 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -102.89 -23.0 13.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.21 -0.931 . . . . 0.0 109.352 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.9 m -55.55 121.38 8.92 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 122.37 1.081 . . . . 0.0 109.629 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -48.07 -50.08 29.41 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.653 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.762 ' O ' HG23 ' A' ' 17' ' ' THR . 10.2 t -141.26 89.3 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.282 -0.886 . . . . 0.0 109.454 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.02 -173.42 28.07 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 m -121.35 -175.18 3.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -1.175 . . . . 0.0 109.5 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.0 m -93.43 131.53 38.54 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.257 -0.902 . . . . 0.0 109.747 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 24' ' ' LYS . 39.2 ttp180 -119.6 119.78 34.77 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.322 -0.862 . . . . 0.0 109.235 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 59.03 15.38 3.97 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.352 -0.843 . . . . 0.0 109.577 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.04 -16.2 39.31 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.881 -1.287 . . . . 0.0 109.881 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 6.0 mtpt -94.98 154.57 17.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.232 -1.157 . . . . 0.0 109.468 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.415 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.037 -1.04 . . . . 0.0 109.494 -179.947 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.275 0.56 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 39.3 mmtt -119.05 -178.99 3.69 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.083 -1.011 . . . . 0.0 110.108 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -140.4 163.25 26.45 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.72 149.34 0.62 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.914 -1.344 . . . . 0.0 109.643 -179.727 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 92.35 -39.41 3.01 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.53 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.62 78.15 0.43 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.365 -1.079 . . . . 0.0 108.145 178.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.9 ptpp? -34.8 159.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.416 0.627 . . . . 0.0 110.265 -179.229 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.592 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -138.84 -175.07 4.02 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -179.61 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.592 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -89.79 -47.29 8.0 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.688 -1.257 . . . . 0.0 108.696 -179.764 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.551 ' HG2' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 173.44 -73.09 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.533 -0.73 . . . . 0.0 110.302 178.634 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.28 58.37 0.82 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.02 -1.05 . . . . 0.0 110.279 -179.272 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmt -101.36 -14.6 17.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.037 -1.039 . . . . 0.0 108.7 178.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 50.37 68.21 0.8 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.396 -0.815 . . . . 0.0 109.925 179.606 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB3' ' CG ' ' A' ' 2' ' ' LYS . 3.9 m-20 -115.35 -21.5 9.82 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 108.79 179.238 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -60.15 123.06 16.01 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.627 1.203 . . . . 0.0 109.188 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.75 -32.84 14.62 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.25 -179.681 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 p -138.62 122.08 17.24 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.907 . . . . 0.0 109.601 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.62 -156.83 26.02 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.6 t -138.5 -179.8 6.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.274 -1.133 . . . . 0.0 109.357 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.496 ' N ' ' OG ' ' A' ' 19' ' ' SER . 19.6 m -59.21 111.2 1.26 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.526 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 24' ' ' LYS . 15.3 tpt180 -103.77 127.52 51.24 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.995 -1.065 . . . . 0.0 109.134 179.345 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 69.59 14.83 8.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.328 -179.684 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.38 -16.76 59.49 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.7 mtpt -114.05 175.55 5.42 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.229 -1.16 . . . . 0.0 109.63 -179.884 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--N 1.303 -1.456 0 C-N-CA 119.083 -1.047 . . . . 0.0 108.61 179.656 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.208 0.528 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtm -107.73 166.93 10.32 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.293 -0.879 . . . . 0.0 109.945 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.89 -178.12 26.73 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -60.75 154.85 20.63 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.064 -1.256 . . . . 0.0 110.555 -179.585 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.419 ' HA2' ' HB2' ' A' ' 24' ' ' LYS . . . 45.91 18.47 0.26 Allowed Glycine 0 N--CA 1.494 2.526 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.14 25.88 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.951 -1.323 . . . . 0.0 110.607 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.2 mtmp? 55.25 150.79 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 122.126 0.965 . . . . 0.0 111.266 179.918 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -156.68 177.08 11.89 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.623 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.553 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -92.0 -44.97 8.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.089 -1.007 . . . . 0.0 108.392 179.196 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.469 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 3.3 ttp180 168.17 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.8 0 O-C-N 121.667 -0.645 . . . . 0.0 109.653 179.053 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 13' ' ' TYR . 0.4 OUTLIER -131.39 27.21 4.77 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.065 -1.022 . . . . 0.0 109.87 -179.878 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.5 -10.59 46.14 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.865 . . . . 0.0 109.787 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.648 ' CE1' HD23 ' A' ' 11' ' ' LEU . 12.5 m-30 55.84 59.77 3.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.203 -0.936 . . . . 0.0 109.402 -179.951 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.46 -24.05 10.39 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.404 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.3 m -59.56 122.05 13.08 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 122.7 1.238 . . . . 0.0 110.056 -179.844 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -57.9 -20.29 35.99 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.743 179.673 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.428 ' O ' HG23 ' A' ' 17' ' ' THR . 2.9 t -154.57 123.62 6.33 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.7 175.31 50.68 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 179.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -169.62 1.67 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.294 -1.121 . . . . 0.0 109.599 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.7 m -75.25 146.48 41.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.152 -0.967 . . . . 0.0 109.446 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -135.33 117.03 14.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.287 -0.883 . . . . 0.0 109.483 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 7.3 t 71.12 4.51 5.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.487 -0.758 . . . . 0.0 109.655 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.36 -1.36 28.03 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -123.37 176.3 6.22 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.348 -1.089 . . . . 0.0 109.191 179.841 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.3 -1.568 0 O-C-N 121.416 -0.802 . . . . 0.0 109.684 179.917 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.294 0.568 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.6 mmmm -106.47 -156.9 0.59 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.357 -0.839 . . . . 0.0 109.661 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -157.31 165.09 33.23 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.63 153.96 0.23 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 120.941 -1.329 . . . . 0.0 109.822 -179.687 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.468 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 86.92 -42.35 3.15 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.773 -1.731 . . . . 0.0 108.773 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -67.73 73.55 0.17 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.43 -1.041 . . . . 0.0 108.253 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -35.26 158.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.555 0.693 . . . . 0.0 110.478 -178.82 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.11 -177.8 4.46 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.806 -178.618 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.572 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -91.77 34.96 0.97 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.311 -0.868 . . . . 0.0 109.725 -179.246 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.572 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 87.89 -75.62 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.638 179.347 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.99 42.88 2.71 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.905 -1.122 . . . . 0.0 110.714 -178.897 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.454 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -83.15 -21.8 33.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.95 -1.094 . . . . 0.0 108.586 179.16 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 56.96 71.87 0.55 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.546 -0.721 . . . . 0.0 110.071 179.436 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 2.2 m-20 -122.95 -15.26 7.42 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.282 -0.886 . . . . 0.0 109.725 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.4 m -67.6 122.3 17.74 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.559 1.171 . . . . 0.0 109.73 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.73 -43.12 47.52 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.362 179.895 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 18' ' ' GLY . 6.6 p -88.66 -116.26 0.06 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.047 -1.033 . . . . 0.0 109.645 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.96 -144.56 0.01 OUTLIER Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -124.17 -148.89 0.41 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.162 -1.199 . . . . 0.0 109.445 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.3 m -79.52 110.8 15.18 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.335 -0.853 . . . . 0.0 109.518 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -102.45 138.22 39.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 109.113 179.536 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 t 47.71 27.58 1.09 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.223 -179.646 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.4 -17.01 41.22 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -102.49 157.67 16.76 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.254 -1.145 . . . . 0.0 109.482 -179.906 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.483 0 C-N-CA 118.831 -1.148 . . . . 0.0 108.305 179.186 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.451 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 11.8 p . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.512 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 8.8 mmtt -128.26 173.14 10.4 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.048 -1.032 . . . . 0.0 110.514 -179.204 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.83 162.46 12.36 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.476 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -55.18 156.08 4.37 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 120.943 -1.327 . . . . 0.0 109.32 -179.911 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.39 -28.19 10.4 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.24 75.96 3.79 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 121.544 -0.974 . . . . 0.0 108.711 179.328 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.666 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -29.79 146.35 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 121.554 0.692 . . . . 0.0 110.766 -179.607 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -126.76 -175.2 3.34 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -179.549 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.42 -52.34 4.96 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.802 -1.186 . . . . 0.0 108.994 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.538 ' CB ' ' O ' ' A' ' 9' ' ' SER . 31.5 ttm180 158.35 100.98 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 76.08 14.44 2.54 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.675 -0.641 . . . . 0.0 109.468 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mtp -61.23 -21.28 63.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.4 -0.812 . . . . 0.0 108.869 179.54 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD2' ' O ' ' A' ' 11' ' ' LEU . 53.8 m-85 60.3 68.63 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.313 -0.867 . . . . 0.0 109.891 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -127.18 -30.88 2.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.922 . . . . 0.0 109.606 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -50.53 124.62 11.1 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.01 -1.057 . . . . 0.0 109.036 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -58.22 -27.84 64.31 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.13 -179.713 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.693 ' O ' HG23 ' A' ' 17' ' ' THR . 5.3 t -131.47 92.97 3.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.657 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.76 -150.65 16.92 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.85 173.59 11.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.401 -1.058 . . . . 0.0 109.281 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.1 m -45.24 135.64 5.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.447 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.432 HH11 ' HG3' ' A' ' 21' ' ' ARG . 19.3 ttm-85 -115.94 118.59 33.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 109.377 179.787 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 44.88 25.35 0.15 Allowed 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.391 -0.818 . . . . 0.0 109.982 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.65 -43.02 1.8 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.666 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -92.78 152.14 19.63 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.078 -1.248 . . . . 0.0 110.416 -179.125 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.51 0 O-C-N 121.397 -0.814 . . . . 0.0 109.203 179.788 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.238 0.542 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 6' ' ' ALA . 9.4 mmtp -115.57 178.42 4.31 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.231 -0.918 . . . . 0.0 110.336 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.458 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.54 169.82 17.47 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.579 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -40.1 149.88 0.06 Allowed 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.362 -1.081 . . . . 0.0 110.213 -179.767 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 89.28 -42.71 3.02 Favored Glycine 0 N--CA 1.487 2.055 0 N-CA-C 108.726 -1.75 . . . . 0.0 108.726 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . . . -64.99 74.79 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.4 -1.059 . . . . 0.0 108.605 179.335 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.27 150.31 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.865 0.841 . . . . 0.0 111.116 -179.748 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -134.69 176.72 8.38 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.198 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.579 ' O ' ' C ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -92.49 112.99 25.14 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.692 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.579 ' C ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -13.6 88.39 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.267 0 CA-C-O 121.443 0.64 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.533 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 2.0 tt 79.59 106.3 0.07 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.682 -0.636 . . . . 0.0 109.789 -179.689 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.566 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -159.63 -35.34 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.503 -0.748 . . . . 0.0 109.452 179.626 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.566 ' CD2' ' O ' ' A' ' 12' ' ' MET . 13.5 m-85 86.51 44.59 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.802 -0.561 . . . . 0.0 110.352 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.458 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 1.1 m-20 -102.4 -36.06 8.57 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.697 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.1 m -58.11 124.96 21.14 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.455 1.121 . . . . 0.0 108.733 179.106 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.17 -27.43 63.82 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.669 -179.613 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -144.07 -81.45 0.18 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.219 -0.926 . . . . 0.0 110.046 -179.628 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -41.12 163.87 0.01 OUTLIER Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -179.486 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.54 171.32 7.43 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -1.156 . . . . 0.0 109.718 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.4 m -75.11 89.66 2.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.231 -0.918 . . . . 0.0 109.513 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -108.42 142.01 39.42 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.013 -1.054 . . . . 0.0 109.631 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.34 37.35 18.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.409 -0.807 . . . . 0.0 108.936 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.73 9.8 47.13 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -179.513 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 30.0 mtpt -117.99 141.06 48.86 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 121.292 -1.122 . . . . 0.0 110.342 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--N 1.302 -1.478 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.081 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 15.7 mmtt -126.35 171.57 10.86 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.329 -0.857 . . . . 0.0 110.237 -179.744 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.49 176.12 16.02 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.027 -1.629 . . . . 0.0 109.027 179.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -55.47 150.21 12.24 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.001 -1.293 . . . . 0.0 109.687 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.53 -28.27 16.24 Favored Glycine 0 N--CA 1.487 2.042 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -179.27 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.538 ' CB ' ' HD2' ' A' ' 2' ' ' LYS . . . -69.48 73.57 0.36 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.679 -0.895 . . . . 0.0 108.671 179.214 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.84 150.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.188 0.518 . . . . 0.0 110.021 -179.768 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -163.58 -167.53 1.44 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.163 -0.961 . . . . 0.0 110.266 -179.44 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.53 -93.19 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.263 -0.898 . . . . 0.0 109.774 -179.532 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.8 OUTLIER -170.88 115.48 0.44 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.406 -0.809 . . . . 0.0 109.341 -179.748 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 80.37 13.99 0.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.624 -0.673 . . . . 0.0 109.346 -179.916 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -60.75 -21.79 63.37 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.31 -0.868 . . . . 0.0 109.212 179.84 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 12' ' ' MET . 3.6 m-85 63.9 52.28 2.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.432 -0.792 . . . . 0.0 110.261 179.448 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -121.65 -29.46 4.36 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.077 -1.015 . . . . 0.0 109.478 179.51 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 3.9 m -57.29 123.79 16.6 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.362 1.077 . . . . 0.0 109.382 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -56.33 -28.42 58.86 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.909 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 17' ' ' THR . 4.6 t -142.64 112.65 7.02 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.908 . . . . 0.0 109.372 -179.985 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.58 -144.41 15.82 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.1 p -151.39 176.68 11.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.186 -1.185 . . . . 0.0 109.778 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 7.9 m -88.7 103.47 15.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.383 -0.823 . . . . 0.0 109.322 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 22' ' ' SER . 44.2 mtp180 -116.64 143.26 45.84 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.303 -179.377 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 79.35 -36.26 0.17 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 109.926 -179.867 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.489 ' C ' ' HG3' ' A' ' 24' ' ' LYS . . . 143.77 -3.01 1.51 Allowed Glycine 0 N--CA 1.487 2.09 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 179.928 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mtmt -141.46 148.64 39.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.706 -1.467 . . . . 0.0 110.764 -179.658 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.559 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.762 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.474 ' C ' ' HD2' ' A' ' 2' ' ' LYS . 17.5 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.334 0.588 . . . . 0.0 109.804 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.589 ' CD ' ' N ' ' A' ' 2' ' ' LYS . 2.0 mptp? -105.13 178.42 4.57 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.422 -0.799 . . . . 0.0 109.915 -179.671 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.7 169.66 22.72 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 108.63 -1.788 . . . . 0.0 108.63 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.448 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 8.0 ptmt -53.07 154.33 3.07 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 120.914 -1.344 . . . . 0.0 109.038 -179.995 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.9 -26.87 12.53 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.898 -2.081 . . . . 0.0 107.898 -178.846 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.88 75.89 3.48 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.936 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -30.49 148.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.35 0.595 . . . . 0.0 110.243 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.585 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -164.67 -162.24 0.63 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.042 -1.036 . . . . 0.0 110.057 -179.648 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.512 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 1.0 OUTLIER -92.32 -141.14 0.2 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.853 -1.154 . . . . 0.0 109.22 -179.567 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -103.05 -64.2 1.1 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.032 -1.042 . . . . 0.0 109.99 -179.566 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.01 50.08 0.87 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.172 -0.955 . . . . 0.0 110.135 -179.573 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.512 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -80.13 -36.66 34.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.148 -0.97 . . . . 0.0 109.034 179.379 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 12' ' ' MET . 29.8 m-85 61.47 48.14 6.12 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.424 -0.798 . . . . 0.0 110.066 179.461 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.473 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -110.04 -11.1 14.66 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.178 -0.951 . . . . 0.0 109.04 179.387 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.9 m -69.07 122.53 18.92 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.339 1.066 . . . . 0.0 109.281 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -46.88 -54.78 9.24 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.988 -179.817 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 t -133.51 54.75 1.93 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.98 . . . . 0.0 109.454 -179.908 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -172.04 -158.06 15.32 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 179.938 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.6 m -143.03 170.07 16.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.173 -1.192 . . . . 0.0 109.683 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 9' ' ' SER . 64.1 m -93.5 85.32 4.89 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.479 -0.763 . . . . 0.0 108.998 179.767 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.528 ' O ' ' CB ' ' A' ' 22' ' ' SER . 31.8 ttp180 -100.25 134.04 43.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.616 -0.677 . . . . 0.0 109.558 -179.148 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER 79.56 -8.77 1.54 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.601 -0.687 . . . . 0.0 109.415 -179.517 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 116.69 -3.54 19.63 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.231 179.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -132.58 147.69 52.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.612 -1.523 . . . . 0.0 110.794 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.585 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.458 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.21 179.874 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.288 0.566 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -120.77 166.9 13.1 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.139 -0.975 . . . . 0.0 110.086 -179.77 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -102.69 162.98 16.35 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -179.929 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.431 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -54.31 161.81 1.25 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.211 -1.17 . . . . 0.0 109.85 -179.774 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.83 18.28 1.8 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -80.4 17.09 1.13 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.968 -1.313 . . . . 0.0 110.574 179.887 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.546 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER 52.68 129.26 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 122.53 1.157 . . . . 0.0 111.559 179.449 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.569 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.4 p -167.58 -168.69 1.06 Allowed 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.564 -0.71 . . . . 0.0 110.3 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 m -93.38 -129.95 0.13 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 109.553 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CZ ' ' HG3' ' A' ' 21' ' ' ARG . 16.6 tpt180 -137.77 109.67 7.18 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 120.807 -1.183 . . . . 0.0 109.419 -179.687 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.542 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 78.13 59.72 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.479 -0.763 . . . . 0.0 109.598 -179.993 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.4 mmm -118.28 -2.81 11.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 109.619 179.901 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 53.28 69.41 0.71 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.172 -0.955 . . . . 0.0 110.046 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.61 -29.86 1.32 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.327 -0.858 . . . . 0.0 109.772 179.559 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 5.6 m -60.42 121.12 11.3 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.452 1.12 . . . . 0.0 109.63 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.62 -35.57 21.55 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.108 -179.987 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.4 t -153.22 56.64 0.77 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.159 -0.963 . . . . 0.0 109.571 -179.898 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.25 -160.38 22.99 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.58 173.85 10.7 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.303 -1.116 . . . . 0.0 109.325 179.992 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 8.2 m -111.81 91.89 3.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.345 179.86 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.557 ' HG3' ' CZ ' ' A' ' 10' ' ' ARG . 2.2 ttm180 -126.67 153.68 45.08 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.405 -0.809 . . . . 0.0 109.204 -179.458 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 78.69 -35.15 0.17 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.335 -0.853 . . . . 0.0 110.111 -179.961 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.31 -4.96 1.36 Allowed Glycine 0 N--CA 1.486 2.021 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.309 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -146.65 162.74 37.82 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.594 -1.533 . . . . 0.0 110.431 -179.914 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.569 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.002 -179.548 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.297 0.57 . . . . 0.0 109.676 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.2 mmtt -122.72 172.68 8.25 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.306 -0.871 . . . . 0.0 110.413 -179.261 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -127.67 163.75 21.29 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.743 -1.743 . . . . 0.0 108.743 179.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.469 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 4.4 pttt -49.77 154.88 0.94 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.885 -1.362 . . . . 0.0 109.071 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.421 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.05 -31.51 6.57 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.766 -2.134 . . . . 0.0 107.766 -178.724 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.71 74.45 0.42 Allowed 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.02 148.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.386 0.612 . . . . 0.0 110.58 -179.369 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.567 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.9 OUTLIER -170.08 -169.37 0.85 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.871 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 10.3 t -93.8 160.49 14.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.943 . . . . 0.0 109.927 -179.354 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.624 ' O ' HD12 ' A' ' 11' ' ' LEU . 10.1 ttp180 -72.42 71.45 0.93 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.348 179.869 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 159.45 -16.24 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.732 -0.605 . . . . 0.0 110.238 179.801 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.466 ' C ' ' O ' ' A' ' 11' ' ' LEU . 4.0 mmm -38.48 -47.19 1.25 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.378 -0.826 . . . . 0.0 109.697 -179.772 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 58.86 26.24 14.61 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 109.531 179.734 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' CE ' ' A' ' 12' ' ' MET . 71.7 m-20 -95.26 -6.32 41.67 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.088 -1.007 . . . . 0.0 109.2 179.611 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.5 m -60.9 126.47 27.5 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.478 1.132 . . . . 0.0 109.089 179.608 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.28 -22.91 0.28 Allowed 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.403 -179.578 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -137.22 -85.88 0.31 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.942 -1.099 . . . . 0.0 110.052 179.867 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.487 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -57.23 -153.54 0.01 OUTLIER Glycine 0 N--CA 1.491 2.361 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.434 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 83.5 p -129.65 -166.04 1.61 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.317 -1.108 . . . . 0.0 109.812 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 21.4 m -98.3 93.79 6.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.257 -0.902 . . . . 0.0 109.773 -179.711 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' O ' ' HB3' ' A' ' 22' ' ' SER . 27.4 ttp180 -112.97 156.58 22.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.552 -0.717 . . . . 0.0 109.33 -179.431 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.441 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 31.4 t 63.22 10.68 4.79 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.243 -0.911 . . . . 0.0 109.338 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 94.58 -5.75 70.36 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.967 -1.111 . . . . 0.0 110.368 179.647 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -136.07 154.54 50.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.675 -1.485 . . . . 0.0 110.93 -179.249 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.567 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.066 179.587 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.305 0.574 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.3 mmtp -112.6 176.12 5.15 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.231 -0.918 . . . . 0.0 109.89 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.407 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -113.78 159.08 13.89 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.175 -1.57 . . . . 0.0 109.175 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -52.47 159.0 1.09 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.24 -1.153 . . . . 0.0 110.075 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.95 15.74 1.06 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.675 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.07 23.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.786 -1.42 . . . . 0.0 110.702 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER 55.34 154.67 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.177 -0.952 . . . . 0.0 110.729 -179.759 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.8 p 163.45 -168.37 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.554 -0.716 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.45 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 1.5 t -92.35 -139.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.45 -0.781 . . . . 0.0 109.561 -179.243 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.576 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER -137.74 114.48 10.55 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.023 -1.048 . . . . 0.0 109.722 -179.455 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.576 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.92 6.67 0.28 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.087 0.47 . . . . 0.0 110.472 179.442 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.427 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -66.52 -30.1 70.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.99 -1.069 . . . . 0.0 108.364 178.962 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 12' ' ' MET . 1.1 m-85 65.35 66.25 0.54 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.536 -0.728 . . . . 0.0 110.166 179.535 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 4.8 p-10 -124.65 -1.3 7.98 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.875 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 4.0 m -81.99 124.74 30.04 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 122.448 1.118 . . . . 0.0 110.275 -179.978 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -50.5 -23.59 2.59 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.359 178.618 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 17' ' ' THR . 9.7 t -153.85 129.73 10.18 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.632 -0.667 . . . . 0.0 109.22 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.0 -145.44 17.72 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.5 m -144.48 -161.35 1.27 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -1.139 . . . . 0.0 109.216 179.984 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 1.3 m -119.71 85.9 2.46 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.139 -0.975 . . . . 0.0 110.129 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -117.97 -176.28 3.01 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.769 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 48.27 23.36 0.54 Allowed 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.115 -0.991 . . . . 0.0 109.267 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.3 6.96 76.89 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.0 mttt -146.49 160.53 41.98 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.871 -1.37 . . . . 0.0 110.705 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.773 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.9 mmtp -137.69 176.21 8.9 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.072 -1.017 . . . . 0.0 110.491 -179.439 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -119.98 175.68 15.96 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.579 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.443 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -57.34 153.55 12.18 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.801 -1.411 . . . . 0.0 109.196 179.888 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.22 -29.95 10.84 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.928 -2.069 . . . . 0.0 107.928 -178.994 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.93 74.13 0.45 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.581 -0.952 . . . . 0.0 108.444 178.977 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.552 ' HA ' ' CB ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -32.51 152.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.407 0.622 . . . . 0.0 110.489 -179.442 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -169.76 -165.57 0.51 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.183 -0.948 . . . . 0.0 110.266 -179.614 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.439 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 39.7 m -92.76 -121.36 0.09 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.258 -0.901 . . . . 0.0 109.393 -179.424 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.508 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 12.8 mtm180 -143.23 115.48 8.45 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.678 -1.264 . . . . 0.0 109.415 -179.93 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.776 HD23 ' N ' ' A' ' 11' ' ' LEU . 1.3 mt 77.06 31.3 0.51 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.711 -0.618 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.496 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -78.92 -19.08 52.69 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.502 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.454 ' HB2' ' O ' ' A' ' 12' ' ' MET . 25.1 m-85 63.63 58.7 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.55 -0.719 . . . . 0.0 111.418 178.486 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.516 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -126.51 -14.81 5.73 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.945 -1.097 . . . . 0.0 109.717 179.095 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.2 m -73.51 129.37 37.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.296 1.045 . . . . 0.0 109.836 -179.943 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -60.87 -18.61 57.17 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.038 -179.743 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 18' ' ' GLY . 25.9 p -117.73 -111.56 0.34 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.113 -0.992 . . . . 0.0 109.257 -179.963 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -150.15 0.01 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 179.981 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.7 p -114.52 -165.98 1.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.345 -1.091 . . . . 0.0 109.65 -179.875 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 1.8 m -87.8 96.67 10.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.304 -0.872 . . . . 0.0 109.715 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -107.48 168.72 9.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.574 -0.704 . . . . 0.0 109.223 -179.679 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t 51.42 20.24 0.96 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.03 -1.044 . . . . 0.0 109.013 -179.52 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.466 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 78.35 2.77 84.79 Favored Glycine 0 N--CA 1.487 2.088 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.855 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.552 ' CB ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mttm -140.0 151.67 45.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.931 -1.335 . . . . 0.0 110.379 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.562 0 C-N-CA 119.91 -0.716 . . . . 0.0 109.41 179.816 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.1 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.6 mmmt -114.07 171.43 7.61 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.168 -0.958 . . . . 0.0 110.372 -179.36 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -119.3 149.13 18.12 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.434 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -44.79 158.4 0.06 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.132 -1.216 . . . . 0.0 109.952 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.04 -2.75 24.76 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.569 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.02 23.26 0.47 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.923 -1.34 . . . . 0.0 111.054 -179.82 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.577 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 1.4 ptmm? 46.93 175.64 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.537 -0.727 . . . . 0.0 109.66 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.577 ' CB ' ' O ' ' A' ' 7' ' ' LYS . 3.7 p 150.8 -172.73 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 CA-C-O 121.394 0.616 . . . . 0.0 109.754 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.458 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 13.9 t -93.35 -132.42 0.15 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.854 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' CYS . 6.7 ptt180 -120.66 -24.65 5.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.732 -1.23 . . . . 0.0 109.861 179.999 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.476 HD12 ' CG ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -108.86 8.96 26.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.195 -0.941 . . . . 0.0 109.51 -179.968 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.456 ' SD ' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -46.26 -49.83 16.8 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.28 -0.888 . . . . 0.0 109.345 179.971 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 54.11 29.22 9.99 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 109.554 179.965 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.456 ' OD2' ' SD ' ' A' ' 12' ' ' MET . 29.6 m-20 -100.98 -4.66 27.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.359 -0.838 . . . . 0.0 109.479 179.858 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -64.68 124.24 21.4 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.331 1.062 . . . . 0.0 109.301 179.572 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.69 -49.75 18.93 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.954 -179.889 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.9 72.72 1.5 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.14 -0.975 . . . . 0.0 109.506 -179.916 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.58 -165.77 34.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.5 p -129.99 -175.29 3.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.194 179.889 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -108.82 114.0 27.41 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.309 -0.87 . . . . 0.0 110.019 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' A' ' 22' ' ' SER . 24.3 mtp180 -145.21 149.34 34.76 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.735 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 80.07 -12.01 1.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.483 -0.761 . . . . 0.0 109.792 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.48 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . 118.53 -3.93 15.3 Favored Glycine 0 N--CA 1.488 2.157 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.286 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mtmt -146.54 164.55 32.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.732 -1.452 . . . . 0.0 111.417 -179.881 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.533 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.771 -179.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.1 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.324 0.583 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.702 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 1.7 mmmm -122.34 168.24 12.31 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.343 -0.848 . . . . 0.0 110.344 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.24 151.42 17.18 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.521 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -46.18 153.05 0.35 Allowed 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.156 -1.203 . . . . 0.0 110.252 -179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 78.88 -18.74 5.74 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.702 ' HB1' ' HE3' ' A' ' 2' ' ' LYS . . . -78.23 46.45 0.61 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.761 -1.435 . . . . 0.0 110.703 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 52.53 164.15 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.221 -0.924 . . . . 0.0 110.824 179.393 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 5.0 p -161.17 170.53 20.18 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.214 -0.929 . . . . 0.0 109.476 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.527 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 6.7 t -98.71 -86.86 0.35 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.254 -0.904 . . . . 0.0 108.967 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HD2' ' O ' ' A' ' 9' ' ' SER . 13.1 mmm180 -156.72 -38.89 0.08 Allowed 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -167.15 42.14 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.288 -0.883 . . . . 0.0 109.325 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.527 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 79.9 mtp -83.38 -15.37 50.13 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.295 -0.878 . . . . 0.0 109.529 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 12' ' ' MET . 12.9 m-85 74.9 49.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.268 -0.895 . . . . 0.0 109.446 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -99.32 -38.93 8.66 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.304 -0.873 . . . . 0.0 109.163 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 8.1 m -54.96 122.84 11.77 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 122.381 1.086 . . . . 0.0 109.658 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -63.12 -37.95 89.25 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.661 -179.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.46 ' O ' ' O ' ' A' ' 18' ' ' GLY . 41.7 p -104.53 -99.69 0.32 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.299 -0.876 . . . . 0.0 109.465 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -143.25 0.01 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.5 t -148.07 -162.88 1.64 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.25 -1.147 . . . . 0.0 109.532 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -46.74 132.2 11.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 110.225 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -146.18 128.86 16.18 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 121.41 -0.806 . . . . 0.0 109.141 179.09 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 21' ' ' ARG . 46.7 t 44.15 25.97 0.13 Allowed 'General case' 0 C--N 1.296 -1.734 0 O-C-N 121.463 -0.773 . . . . 0.0 109.863 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.463 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 96.36 -26.44 21.44 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.637 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.5 mptp? -103.26 165.4 11.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.312 -1.111 . . . . 0.0 109.321 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.521 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -62.83 161.25 12.99 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.169 -0.957 . . . . 0.0 109.908 -179.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.428 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.302 -1.485 0 O-C-N 120.276 -1.515 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.5 p . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 121.312 0.577 . . . . 0.0 109.679 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.733 ' NZ ' ' HB1' ' A' ' 6' ' ' ALA . 5.6 mmmt -109.13 -141.34 0.38 Allowed 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.3 -0.875 . . . . 0.0 109.678 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 25' ' ' CYS . . . -178.87 163.0 30.42 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 108.915 -1.674 . . . . 0.0 108.915 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.457 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -47.84 149.07 1.39 Allowed 'General case' 0 C--N 1.307 -1.269 0 O-C-N 120.896 -1.356 . . . . 0.0 109.275 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.74 -39.99 3.1 Favored Glycine 0 N--CA 1.487 2.074 0 N-CA-C 108.454 -1.859 . . . . 0.0 108.454 -179.148 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.733 ' HB1' ' NZ ' ' A' ' 2' ' ' LYS . . . -67.32 71.41 0.11 Allowed 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.425 -1.044 . . . . 0.0 108.495 179.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.633 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.92 153.13 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.426 0 CA-C-O 121.763 0.792 . . . . 0.0 110.697 -179.211 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -131.94 -174.81 3.53 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -179.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 4.0 m -90.33 -46.84 8.13 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.659 -1.276 . . . . 0.0 108.701 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 9' ' ' SER . 1.9 mmm180 179.2 -87.55 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.614 -0.678 . . . . 0.0 109.746 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -94.95 21.32 7.77 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.046 -1.034 . . . . 0.0 109.827 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.46 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -56.35 -25.3 48.84 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.244 -0.91 . . . . 0.0 109.184 179.759 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 48.07 64.9 1.46 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.359 -0.838 . . . . 0.0 109.788 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.507 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 1.1 m-20 -119.82 -24.77 6.05 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.18 -0.95 . . . . 0.0 109.541 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.437 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 4.1 m -53.45 120.79 6.54 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.42 1.105 . . . . 0.0 109.443 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -47.03 -35.14 6.42 Favored 'General case' 0 C--N 1.288 -2.075 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.694 179.716 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 38.7 p -85.89 -137.07 0.07 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.393 -0.817 . . . . 0.0 109.366 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.47 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -52.99 -105.06 0.01 OUTLIER Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.1 p -151.08 -158.26 0.9 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.038 -1.272 . . . . 0.0 109.785 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.417 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 7.2 m -68.03 137.27 54.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.368 -0.833 . . . . 0.0 109.698 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 -125.92 125.08 42.18 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.232 -0.918 . . . . 0.0 109.091 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.8 p 50.52 22.42 1.05 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.384 -0.823 . . . . 0.0 109.335 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.98 -19.76 53.0 Favored Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.633 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -100.47 140.96 33.98 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.378 -1.072 . . . . 0.0 109.409 179.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.498 ' HB3' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER -57.32 171.74 0.38 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.02 -1.05 . . . . 0.0 108.916 179.927 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 119.809 -1.807 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.8 p . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.253 0.549 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 20.6 mmtm -112.98 165.06 12.7 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.236 -0.915 . . . . 0.0 110.314 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.438 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.56 163.33 19.73 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -52.02 155.43 1.86 Allowed 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.175 -1.191 . . . . 0.0 110.152 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 59.62 8.24 7.13 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 18.34 0.88 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.852 -1.381 . . . . 0.0 110.587 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.04 154.13 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.189 -0.944 . . . . 0.0 110.713 -179.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -157.06 178.8 9.94 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.775 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 8.9 t -91.74 -45.43 8.43 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.831 -1.168 . . . . 0.0 108.646 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.434 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 176.91 -83.42 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.866 0 O-C-N 121.753 -0.592 . . . . 0.0 109.771 179.126 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.99 24.17 12.29 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.272 -0.893 . . . . 0.0 109.756 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 74.5 mmm -61.33 -16.53 46.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.051 -1.031 . . . . 0.0 109.256 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 58.25 60.96 2.45 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.287 -0.883 . . . . 0.0 109.572 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -106.81 -26.05 11.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.406 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -55.41 122.18 10.62 Favored 'General case' 0 N--CA 1.49 1.53 0 CA-C-O 122.349 1.071 . . . . 0.0 109.562 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -53.68 -43.15 68.64 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.846 -179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.709 ' O ' HG23 ' A' ' 17' ' ' THR . 6.7 t -139.86 88.08 2.21 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 109.521 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.67 -162.53 26.61 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.3 p -132.7 -165.51 1.61 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.257 -1.143 . . . . 0.0 109.371 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.404 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 23.5 m -92.03 136.51 33.11 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.186 -0.946 . . . . 0.0 109.697 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -125.38 106.94 10.2 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.19 -0.944 . . . . 0.0 108.813 179.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.74 12.38 7.59 Favored 'General case' 0 C--N 1.294 -1.821 0 O-C-N 121.592 -0.693 . . . . 0.0 109.336 -179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 7' ' ' LYS . . . 112.26 -16.5 24.72 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.9 mtpt -94.19 145.8 24.45 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.615 -0.932 . . . . 0.0 109.356 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.07 175.97 3.47 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.113 -0.992 . . . . 0.0 109.454 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.368 0 O-C-N 119.95 -1.719 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.421 0.629 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' CD ' ' N ' ' A' ' 2' ' ' LYS . 10.1 mptt -97.67 167.42 10.97 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.329 -0.857 . . . . 0.0 109.785 179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.19 170.69 17.13 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.341 -1.904 . . . . 0.0 108.341 179.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.445 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -49.38 147.27 3.34 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 120.738 -1.448 . . . . 0.0 108.896 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.23 -31.7 6.17 Favored Glycine 0 N--CA 1.487 2.05 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.03 75.48 0.93 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.587 -0.949 . . . . 0.0 108.465 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.77 152.46 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.219 0.533 . . . . 0.0 110.58 -179.448 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.603 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.3 -177.6 4.79 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.729 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.603 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m -91.24 -62.5 1.43 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.791 -1.193 . . . . 0.0 109.074 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.497 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 166.01 102.4 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.497 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.18 15.64 1.37 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.599 -0.688 . . . . 0.0 109.454 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.439 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 3.9 mmm -69.71 -18.99 63.57 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.281 -0.887 . . . . 0.0 109.367 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.439 ' HB2' ' O ' ' A' ' 12' ' ' MET . 43.8 m-85 60.53 66.96 0.87 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.318 -0.864 . . . . 0.0 109.169 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -123.3 -22.44 5.1 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.356 -0.84 . . . . 0.0 109.767 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.3 m -64.27 119.93 11.22 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 122.483 1.135 . . . . 0.0 110.315 -179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.87 -38.37 55.79 Favored 'General case' 0 C--N 1.287 -2.123 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.42 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.48 102.71 4.53 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.389 -0.819 . . . . 0.0 109.397 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 117.99 -166.68 12.77 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.3 p -128.85 173.18 10.6 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.129 -1.219 . . . . 0.0 109.435 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.5 m -60.64 102.68 0.2 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.274 -0.891 . . . . 0.0 109.492 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.545 ' N ' ' O ' ' A' ' 24' ' ' LYS . 34.4 ttp180 -99.9 139.88 34.93 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.155 -0.965 . . . . 0.0 109.118 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 58.73 18.75 6.23 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.081 -1.012 . . . . 0.0 109.353 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.38 -11.9 70.81 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.9 mtpp -119.71 170.04 9.56 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.084 -1.245 . . . . 0.0 109.569 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.445 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m -72.05 159.76 33.63 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.187 -0.946 . . . . 0.0 109.472 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.623 0 O-C-N 120.271 -1.518 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.7 p . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.402 0.62 . . . . 0.0 109.598 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.569 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 6.5 mmtp -119.33 -179.98 4.02 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.495 -0.753 . . . . 0.0 110.108 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -123.74 163.49 17.31 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -44.81 158.88 0.05 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.216 -1.167 . . . . 0.0 109.308 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 90.08 -34.57 4.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 108.869 -1.692 . . . . 0.0 108.869 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.467 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.5 72.57 0.99 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.381 -1.07 . . . . 0.0 108.449 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -35.52 156.18 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.179 0.514 . . . . 0.0 110.406 -179.159 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -136.26 -177.32 4.65 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.025 -1.047 . . . . 0.0 108.448 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.3 -62.51 1.42 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.898 -1.126 . . . . 0.0 109.256 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.52 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 167.9 96.94 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.894 0 O-C-N 121.564 -0.71 . . . . 0.0 109.923 179.418 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.52 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 78.84 54.56 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.579 -0.701 . . . . 0.0 109.547 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.402 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -108.31 -18.8 13.67 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' MET . 88.9 m-85 60.46 80.94 0.19 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' A' ' 2' ' ' LYS . 3.6 m-20 -144.93 -37.8 0.28 Allowed 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.248 -0.908 . . . . 0.0 109.347 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.7 m -60.37 126.13 26.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.42 1.105 . . . . 0.0 108.661 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -59.43 -36.51 76.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 46.5 p -108.1 135.91 48.66 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.057 -1.027 . . . . 0.0 109.513 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 51.12 -150.4 6.61 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.63 -164.13 1.45 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.393 -1.063 . . . . 0.0 109.469 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -61.28 107.72 0.81 Allowed 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.465 -0.772 . . . . 0.0 109.854 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.532 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -97.17 137.99 35.36 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.004 -1.06 . . . . 0.0 109.05 179.313 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.6 20.77 1.14 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.363 -0.836 . . . . 0.0 109.275 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.7 -16.73 60.1 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.686 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 61.2 mttt -106.06 174.08 6.04 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.11 -1.229 . . . . 0.0 110.157 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -73.4 162.65 29.06 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.92 -1.112 . . . . 0.0 108.819 179.664 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.493 0 O-C-N 120.103 -1.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.639 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 7.0 mmtt -134.04 168.48 18.73 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.123 -0.986 . . . . 0.0 110.377 -179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -100.79 170.05 21.63 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -60.8 159.81 10.5 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.157 -1.202 . . . . 0.0 109.918 -179.81 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 60.22 8.39 8.77 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -80.37 15.96 1.45 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 120.914 -1.345 . . . . 0.0 110.412 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.89 153.85 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.505 0 CA-C-O 121.862 0.839 . . . . 0.0 110.675 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.609 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -159.64 -177.94 6.74 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 179.41 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.609 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.2 -56.0 3.39 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 120.875 -1.141 . . . . 0.0 108.563 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CB ' ' O ' ' A' ' 9' ' ' SER . 1.1 ptm180 159.33 101.15 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.765 0 CA-C-O 121.306 0.574 . . . . 0.0 109.655 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.55 51.96 0.46 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.679 -0.638 . . . . 0.0 109.799 179.668 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.503 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 1.9 mtp -106.28 -7.56 17.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.373 -0.83 . . . . 0.0 109.275 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.0 m-85 54.19 51.6 14.16 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.268 -0.895 . . . . 0.0 109.457 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.503 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 9.3 m-20 -104.62 -14.46 15.61 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.369 -0.832 . . . . 0.0 109.478 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.9 m -67.18 124.53 23.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-O 122.496 1.141 . . . . 0.0 109.706 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -59.84 -9.91 3.39 Favored 'General case' 0 C--N 1.289 -2.042 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.987 -179.489 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 71.3 p -133.14 1.6 3.53 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.713 -1.242 . . . . 0.0 111.093 -179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -178.1 -145.2 5.86 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.159 -1.496 . . . . 0.0 110.41 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -119.74 -171.02 2.05 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.392 -1.064 . . . . 0.0 109.326 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.2 m -70.29 142.14 52.29 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 110.172 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -125.24 125.39 43.51 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 31.0 p 54.94 17.94 2.03 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.553 -0.717 . . . . 0.0 109.465 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.94 -45.71 1.28 Allowed Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.902 -1.279 . . . . 0.0 109.902 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.5 mttt -93.52 162.14 14.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.281 -1.129 . . . . 0.0 109.758 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.9 OUTLIER -64.76 171.01 3.66 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.241 -0.912 . . . . 0.0 109.641 -179.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.403 0 O-C-N 119.875 -1.766 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 3.9 mmtm -127.29 174.73 8.72 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.299 -0.876 . . . . 0.0 110.121 -179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -120.04 168.49 13.74 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -48.49 154.45 0.64 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.882 -1.364 . . . . 0.0 109.515 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.78 -40.04 2.84 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 107.536 -2.226 . . . . 0.0 107.536 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -72.19 78.61 0.97 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 178.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.751 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.7 OUTLIER -35.86 157.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 121.767 0.794 . . . . 0.0 110.676 -178.671 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -132.73 -177.55 4.54 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -179.31 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.595 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.42 -45.75 8.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.708 -1.245 . . . . 0.0 109.261 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 31.1 ttt180 -175.08 -85.22 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.707 0 O-C-N 121.477 -0.764 . . . . 0.0 109.899 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.461 HD23 ' CZ ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -122.68 33.81 5.32 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.003 -1.061 . . . . 0.0 109.854 -179.671 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.2 mtt -67.8 -8.82 39.09 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.223 -0.923 . . . . 0.0 109.152 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 12' ' ' MET . 23.7 m-85 62.38 58.68 1.68 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.302 -0.874 . . . . 0.0 109.634 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.11 -41.21 5.89 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.216 -0.928 . . . . 0.0 109.315 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -55.3 123.77 14.89 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 122.439 1.114 . . . . 0.0 109.017 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.97 -28.79 54.24 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.065 -179.721 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 p -139.22 158.95 43.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.191 -0.943 . . . . 0.0 109.545 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 61.39 -146.81 48.11 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.4 p -150.85 171.12 17.73 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.253 -1.145 . . . . 0.0 109.602 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 20.9 m -56.5 114.9 2.22 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.377 -0.827 . . . . 0.0 109.553 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 18.0 mtt180 -119.03 141.82 48.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.124 -0.985 . . . . 0.0 109.247 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 11.2 t 51.4 21.98 1.34 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.166 -0.958 . . . . 0.0 109.068 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.63 -10.77 58.65 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.751 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.1 mttp -106.66 152.57 23.59 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.13 -1.217 . . . . 0.0 109.665 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.471 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.7 OUTLIER -63.06 167.8 4.61 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 119.224 -0.99 . . . . 0.0 108.596 179.486 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.541 0 O-C-N 119.972 -1.705 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.284 0.564 . . . . 0.0 109.55 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.628 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 4.4 mmtp -119.07 169.89 9.53 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.178 -0.951 . . . . 0.0 110.041 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.48 177.47 18.48 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.873 -1.691 . . . . 0.0 108.873 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.6 pttt -59.53 153.63 19.2 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 120.89 -1.359 . . . . 0.0 109.447 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 88.66 -32.47 4.51 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.628 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -67.19 67.44 0.07 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.351 -1.087 . . . . 0.0 109.356 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -20.8 136.8 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.74 0 CA-C-O 121.768 0.794 . . . . 0.0 111.831 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.2 -178.28 3.63 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.789 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -91.71 31.55 1.19 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.132 -0.98 . . . . 0.0 109.79 -178.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' SER . 5.7 ttm180 81.19 -43.59 0.19 Allowed 'General case' 0 C--N 1.293 -1.871 0 O-C-N 121.981 -0.449 . . . . 0.0 110.262 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -149.95 81.61 1.38 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.819 -1.176 . . . . 0.0 110.72 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.462 ' HG3' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -128.78 -9.19 4.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.101 -1.0 . . . . 0.0 109.613 178.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 58.22 59.55 3.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.036 -1.04 . . . . 0.0 109.85 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.01 -25.64 7.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.921 . . . . 0.0 109.181 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.4 m -56.75 123.75 16.05 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.393 1.092 . . . . 0.0 109.706 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.01 -19.89 34.58 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.236 179.535 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.4 p -93.52 -133.47 0.16 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.49 -0.756 . . . . 0.0 109.262 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -64.92 -95.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -147.54 -171.61 3.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.229 -1.16 . . . . 0.0 109.594 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.9 m -62.56 142.58 57.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.163 -0.96 . . . . 0.0 109.511 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.71 134.5 45.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.165 -0.959 . . . . 0.0 108.982 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.6 p 47.93 22.72 0.4 Allowed 'General case' 0 C--N 1.299 -1.589 0 O-C-N 121.504 -0.748 . . . . 0.0 109.415 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.25 -32.25 6.62 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.764 -1.334 . . . . 0.0 109.764 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 2.4 mttt -93.67 148.5 22.05 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.244 -1.151 . . . . 0.0 109.743 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.471 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -60.68 178.37 0.23 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.087 -1.008 . . . . 0.0 109.138 -179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.348 0 O-C-N 120.003 -1.686 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -110.19 165.01 12.09 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.238 -0.914 . . . . 0.0 110.233 -179.643 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.448 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -105.49 164.96 14.02 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.1 mtpm? -51.53 151.43 3.16 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.073 -1.251 . . . . 0.0 110.012 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.89 4.76 22.14 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.89 17.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.957 -1.32 . . . . 0.0 110.618 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 56.44 149.06 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.191 -0.943 . . . . 0.0 111.15 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -155.98 176.5 12.56 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.791 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.568 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.17 -53.7 4.13 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.033 -1.042 . . . . 0.0 108.712 179.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.516 ' CB ' ' O ' ' A' ' 9' ' ' SER . 7.6 ptt180 161.14 94.08 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 66.63 55.15 0.8 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.55 -0.719 . . . . 0.0 109.327 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.434 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -99.14 -9.48 23.74 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.438 179.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 12' ' ' MET . 14.2 m-85 69.02 31.56 4.08 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.17 -0.956 . . . . 0.0 109.607 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -97.9 -35.89 10.34 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.356 -0.84 . . . . 0.0 108.949 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -54.89 123.49 13.61 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 122.475 1.131 . . . . 0.0 109.989 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -62.61 -13.15 28.23 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.524 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.431 ' O ' ' C ' ' A' ' 18' ' ' GLY . 13.3 t -144.85 155.02 43.25 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.351 -0.843 . . . . 0.0 109.912 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.431 ' C ' ' O ' ' A' ' 17' ' ' THR . . . 42.11 -145.96 0.72 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 57.7 p -133.15 -166.53 1.78 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.328 -1.101 . . . . 0.0 109.375 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.3 m -70.91 129.42 39.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.218 -0.926 . . . . 0.0 109.544 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.526 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -114.17 125.17 53.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.284 -0.885 . . . . 0.0 109.182 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.77 15.54 2.26 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.349 -0.844 . . . . 0.0 109.848 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 110.06 -34.78 5.23 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -93.68 165.84 12.52 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -1.188 . . . . 0.0 109.622 -179.681 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.55 170.22 4.19 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.151 -0.968 . . . . 0.0 109.649 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.32 0 O-C-N 119.878 -1.764 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.439 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 7.9 p . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.573 ' HD2' ' HB2' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -146.62 167.29 24.13 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.263 -0.898 . . . . 0.0 110.485 -179.475 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.21 -172.15 28.54 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 108.599 -1.8 . . . . 0.0 108.599 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.1 160.07 6.63 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.858 -1.377 . . . . 0.0 109.312 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.41 -13.99 48.3 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HB2' ' HD2' ' A' ' 2' ' ' LYS . . . -73.26 60.83 0.61 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.346 -1.09 . . . . 0.0 108.989 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.564 ' C ' ' O ' ' A' ' 6' ' ' ALA . 11.4 mtmt -18.36 131.67 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 CA-C-O 121.836 0.827 . . . . 0.0 111.803 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.579 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -120.85 -179.2 3.94 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 107.991 -1.115 . . . . 0.0 107.991 -179.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.579 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -91.4 -58.52 2.41 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.875 -1.141 . . . . 0.0 108.778 179.562 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.676 ' O ' HD12 ' A' ' 11' ' ' LEU . 10.2 ptm180 177.05 24.91 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.77 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.676 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 160.98 -18.35 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.05 -1.031 . . . . 0.0 110.624 179.405 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.464 ' C ' ' O ' ' A' ' 11' ' ' LEU . 1.1 mmt -39.03 -29.87 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.434 -0.791 . . . . 0.0 109.748 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.479 ' N ' ' O ' ' A' ' 11' ' ' LEU . 3.3 m-85 64.41 62.49 0.81 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.376 -0.828 . . . . 0.0 110.34 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -99.38 -15.16 18.87 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.089 -1.007 . . . . 0.0 108.992 179.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.8 m -64.7 125.04 23.51 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 122.252 1.025 . . . . 0.0 108.798 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -50.7 -52.73 37.38 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.195 -179.611 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 17' ' ' THR . 4.8 t -135.61 59.31 1.72 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.001 -1.062 . . . . 0.0 109.642 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.67 -173.11 41.1 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.5 m -125.52 -169.13 1.94 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.185 -1.185 . . . . 0.0 109.556 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.2 m -86.79 111.23 20.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.868 . . . . 0.0 109.622 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -114.59 129.37 56.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.143 -0.973 . . . . 0.0 109.119 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.69 9.07 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.083 -1.01 . . . . 0.0 109.103 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.92 -9.22 69.82 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.8 mttt -109.81 146.24 35.37 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.366 -1.079 . . . . 0.0 109.697 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.08 166.84 0.48 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.253 -0.904 . . . . 0.0 109.145 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.59 0 O-C-N 120.045 -1.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.7 p . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.141 0.496 . . . . 0.0 109.662 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 12.0 mmtm -116.08 163.07 16.48 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.328 -0.858 . . . . 0.0 110.187 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -98.26 167.06 22.35 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -61.05 159.54 11.49 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.134 -1.215 . . . . 0.0 110.172 -179.436 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.3 -0.64 15.92 Favored Glycine 0 N--CA 1.494 2.519 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.91 18.35 0.82 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.837 -1.39 . . . . 0.0 111.024 -179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.27 146.92 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.48 0 CA-C-O 122.015 0.912 . . . . 0.0 111.076 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.566 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.6 p 172.48 178.11 0.08 Allowed 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 119.822 -0.751 . . . . 0.0 109.909 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 40.4 t -93.6 151.55 19.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.195 -0.941 . . . . 0.0 109.201 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 9' ' ' SER . 6.0 mtm180 -39.64 -37.88 0.56 Allowed 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.47 ' O ' ' C ' ' A' ' 12' ' ' MET . 2.6 mp -85.88 -111.34 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.47 ' C ' ' O ' ' A' ' 11' ' ' LEU . 33.3 mtt 39.5 75.33 0.08 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.191 -0.943 . . . . 0.0 109.636 179.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -72.56 50.89 0.25 Allowed 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.164 -0.96 . . . . 0.0 109.711 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.4 ' O ' ' C ' ' A' ' 15' ' ' CYS . 72.1 m-20 -95.02 -29.75 14.45 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.469 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 40.1 m -44.42 126.19 5.16 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-O 122.217 1.008 . . . . 0.0 109.667 179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -64.91 -6.17 7.76 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.666 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 p -138.65 25.54 2.59 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.762 -1.211 . . . . 0.0 110.742 -179.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.469 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . 145.45 -122.61 1.73 Allowed Glycine 0 N--CA 1.492 2.423 0 C-N-CA 119.442 -1.361 . . . . 0.0 110.09 179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.534 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 14.3 t -147.37 -163.71 1.83 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.335 -1.097 . . . . 0.0 109.321 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.534 ' N ' ' OG ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -78.29 132.85 37.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.18 -0.95 . . . . 0.0 111.381 -179.767 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.538 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.1 ttm180 -119.29 114.37 22.28 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 2.0 t 79.52 -23.7 0.23 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.705 -0.622 . . . . 0.0 110.365 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.439 ' C ' ' SG ' ' A' ' 20' ' ' CYS . . . 150.22 -14.29 0.97 Allowed Glycine 0 N--CA 1.491 2.33 0 N-CA-C 110.037 -1.225 . . . . 0.0 110.037 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 45.9 mttt -128.46 156.64 42.9 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.905 -1.35 . . . . 0.0 110.494 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.566 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.3 m -53.85 169.39 0.16 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 120.064 -0.654 . . . . 0.0 109.817 -179.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 120.101 -1.625 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 37.6 mmtt -125.18 172.5 9.47 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.208 -0.932 . . . . 0.0 110.402 -179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.91 172.74 14.37 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.702 -1.759 . . . . 0.0 108.702 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.477 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 5.1 pttm -58.78 155.62 12.59 Favored 'General case' 0 C--N 1.304 -1.408 0 O-C-N 120.885 -1.362 . . . . 0.0 109.516 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.51 -30.67 7.08 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.495 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.11 75.46 3.68 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.653 -0.91 . . . . 0.0 108.699 179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.67 150.23 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 CA-C-O 121.528 0.68 . . . . 0.0 110.48 -179.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -128.66 -178.15 4.48 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.368 -0.832 . . . . 0.0 109.124 -179.531 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.527 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.0 35.39 0.98 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.218 -0.926 . . . . 0.0 109.848 -179.131 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.566 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER 55.33 93.17 0.02 OUTLIER 'General case' 0 C--N 1.287 -2.151 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 -179.273 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.566 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.31 62.5 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.516 0.674 . . . . 0.0 109.717 -179.609 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.483 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 2.6 mtp -117.9 -21.16 8.49 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.351 -0.843 . . . . 0.0 108.971 179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.4 m-30 60.73 48.04 7.47 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.314 -0.866 . . . . 0.0 109.645 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 30.9 m-20 -111.46 -31.18 7.11 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.232 -0.917 . . . . 0.0 109.51 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 4.0 m -50.72 122.39 7.22 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 122.311 1.053 . . . . 0.0 108.923 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -51.55 -26.89 9.41 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.356 -179.463 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -132.52 113.24 12.86 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.232 -0.918 . . . . 0.0 109.805 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.41 -140.13 17.2 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.6 p -140.92 -169.46 2.82 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.316 -1.108 . . . . 0.0 109.248 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.1 m -60.43 153.43 23.06 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.167 -0.958 . . . . 0.0 109.358 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -122.72 108.74 13.4 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.358 -0.839 . . . . 0.0 109.161 179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 44.46 26.08 0.16 Allowed 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.694 -0.629 . . . . 0.0 109.395 -179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.463 ' HA3' ' NH2' ' A' ' 10' ' ' ARG . . . 111.5 -27.69 10.33 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.89 -1.284 . . . . 0.0 109.89 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.0 mttt -102.79 135.15 44.98 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.208 -1.172 . . . . 0.0 109.837 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.477 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -56.52 174.57 0.14 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.211 -0.93 . . . . 0.0 108.777 179.614 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.39 0 O-C-N 119.805 -1.809 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.0 p . . . . . 0 N--CA 1.489 1.486 0 CA-C-O 121.241 0.543 . . . . 0.0 109.555 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.684 ' HE3' ' HB1' ' A' ' 6' ' ' ALA . 3.5 mmmt -113.57 169.75 8.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.312 -0.868 . . . . 0.0 109.744 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.79 172.35 18.15 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.548 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.0 OUTLIER -62.09 147.51 47.18 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.149 -1.207 . . . . 0.0 108.775 179.57 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.548 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 63.73 6.36 16.89 Favored Glycine 0 N--CA 1.493 2.464 0 N-CA-C 110.34 -1.104 . . . . 0.0 110.34 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.684 ' HB1' ' HE3' ' A' ' 2' ' ' LYS . . . -79.54 19.26 0.64 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.004 -1.291 . . . . 0.0 110.816 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.55 149.46 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.167 -0.958 . . . . 0.0 111.427 179.682 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.612 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -152.64 -178.05 6.62 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 107.691 -1.226 . . . . 0.0 107.691 179.479 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.612 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.14 -69.36 0.73 Allowed 'General case' 0 C--N 1.305 -1.352 0 O-C-N 120.699 -1.251 . . . . 0.0 108.279 179.322 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 166.19 108.32 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.078 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 69.68 44.95 0.82 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.515 -0.741 . . . . 0.0 109.58 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.485 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 23.3 mmt -109.95 -23.3 11.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.314 -0.866 . . . . 0.0 109.236 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 62.74 52.34 2.81 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.367 -0.833 . . . . 0.0 109.796 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -101.99 -21.15 14.55 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.241 -0.912 . . . . 0.0 109.086 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.1 m -63.14 123.06 17.66 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 122.589 1.185 . . . . 0.0 109.811 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.04 -22.01 2.13 Favored 'General case' 0 C--N 1.287 -2.111 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.281 179.547 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.44 144.7 34.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.49 -0.756 . . . . 0.0 109.324 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.33 -146.93 45.68 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.5 m -144.46 -163.92 1.79 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.128 -1.219 . . . . 0.0 109.67 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 m -74.88 153.29 38.72 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.16 -0.962 . . . . 0.0 109.774 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 24' ' ' LYS . 5.1 ttt180 -145.77 116.08 7.51 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.458 ' HB2' ' CE ' ' A' ' 24' ' ' LYS . 34.8 m 61.42 15.54 6.7 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.457 -0.777 . . . . 0.0 109.565 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 103.01 -6.24 51.13 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.6 OUTLIER -110.7 161.67 15.52 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.284 -1.127 . . . . 0.0 109.64 -179.869 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.82 174.36 8.58 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.212 -0.93 . . . . 0.0 109.619 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 119.91 -1.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.1 p . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.335 0.588 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.496 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 25.4 mmtp -111.77 168.29 9.69 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.809 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -114.29 167.83 12.42 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.606 ' NZ ' HG21 ' A' ' 17' ' ' THR . 0.8 OUTLIER -46.91 165.44 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.306 -1.114 . . . . 0.0 110.074 -179.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 54.52 18.27 10.12 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.14 -1.584 . . . . 0.0 109.14 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.809 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -78.64 15.86 0.96 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.33 -1.1 . . . . 0.0 111.327 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.512 ' C ' ' O ' ' A' ' 6' ' ' ALA . 7.4 ptmm? 31.66 44.66 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 122.018 0.913 . . . . 0.0 109.68 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' N ' ' O ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -49.21 178.31 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.886 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 -178.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.555 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -92.25 36.4 0.99 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.042 -1.036 . . . . 0.0 109.57 -179.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.638 ' HG2' HD23 ' A' ' 11' ' ' LEU . 2.0 ttp180 79.02 -80.94 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.978 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.638 HD23 ' HG2' ' A' ' 10' ' ' ARG . 2.0 mm? -115.53 79.62 1.32 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.001 -1.062 . . . . 0.0 109.487 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.463 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 2.8 mtt -122.53 -9.26 8.49 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.279 -0.888 . . . . 0.0 109.487 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 58.48 59.77 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.248 -0.907 . . . . 0.0 109.684 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -122.12 -21.21 6.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.204 -0.935 . . . . 0.0 109.679 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 19' ' ' SER . 57.5 m -58.32 119.63 7.27 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 122.483 1.135 . . . . 0.0 110.167 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -54.35 -18.4 4.05 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.707 179.402 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.606 HG21 ' NZ ' ' A' ' 4' ' ' LYS . 2.4 t -114.98 -121.28 0.3 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.194 -0.942 . . . . 0.0 109.833 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.464 ' N ' HG23 ' A' ' 17' ' ' THR . . . -61.2 -131.37 0.01 OUTLIER Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.446 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.8 t -115.05 -149.36 0.44 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.19 -1.182 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 25.9 m -96.7 137.19 36.15 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.33 -0.856 . . . . 0.0 109.803 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 -107.08 117.02 32.97 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 50.11 23.04 1.04 Allowed 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.324 -0.86 . . . . 0.0 108.993 -179.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.597 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.76 -28.63 14.58 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.339 -1.505 . . . . 0.0 109.339 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 4.0 mttm -92.34 134.25 35.09 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 120.9 -1.353 . . . . 0.0 109.0 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 1.7 m -55.2 178.38 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.946 0 O-C-N 121.736 -0.603 . . . . 0.0 109.687 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.449 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.303 -1.428 0 O-C-N 120.01 -1.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.357 0.599 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.7 mmtt -126.9 172.93 10.0 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.261 -0.899 . . . . 0.0 110.443 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -113.78 -175.5 19.05 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 108.712 -1.755 . . . . 0.0 108.712 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' A' ' 5' ' ' GLY . 0.3 OUTLIER -62.59 145.18 55.08 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.775 -1.426 . . . . 0.0 108.108 179.411 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.539 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . 106.22 -32.26 7.52 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 108.147 -1.981 . . . . 0.0 108.147 -178.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.474 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -72.24 76.14 0.99 Allowed 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.5 153.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.463 0.649 . . . . 0.0 110.691 -179.263 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.578 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -137.14 -175.12 3.94 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.578 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.2 t -90.28 -44.11 9.93 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.457 -1.402 . . . . 0.0 109.771 -179.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 9' ' ' SER . 3.0 ptm180 175.97 -34.76 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.82 0 O-C-N 121.332 -0.855 . . . . 0.0 109.981 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.81 23.4 0.77 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.079 -1.013 . . . . 0.0 110.078 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 35.2 mmt -60.27 -16.05 30.58 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.073 -1.017 . . . . 0.0 109.121 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 50.21 47.36 23.77 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.273 -0.892 . . . . 0.0 109.512 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -94.67 -19.62 20.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 109.004 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 2.8 m -63.88 124.63 22.02 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.376 1.084 . . . . 0.0 108.522 179.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -50.65 -52.27 41.3 Favored 'General case' 0 C--N 1.287 -2.126 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.829 -179.21 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.527 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.7 p -115.97 -61.81 1.68 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.091 -1.006 . . . . 0.0 110.216 -179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.527 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -62.37 -162.44 0.27 Allowed Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.95 173.66 11.51 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.395 -1.062 . . . . 0.0 108.863 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 m -58.62 91.94 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.04 -1.037 . . . . 0.0 109.363 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 24' ' ' LYS . 12.0 ttm180 -96.95 122.06 39.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.098 -1.001 . . . . 0.0 109.404 179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 t 58.6 30.69 20.19 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.416 -0.803 . . . . 0.0 109.485 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.16 -10.5 63.24 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.5 mtmt -109.45 141.51 41.77 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.283 -1.128 . . . . 0.0 109.546 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -55.34 165.14 0.81 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 109.295 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.599 0 O-C-N 120.152 -1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.8 p . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -120.76 176.58 5.46 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.1 -1.0 . . . . 0.0 110.294 -179.595 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -116.15 167.92 12.58 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.44 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -60.75 153.29 24.64 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.022 -1.281 . . . . 0.0 109.514 -179.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.409 ' HA2' ' HD2' ' A' ' 24' ' ' LYS . . . 62.67 -0.24 2.33 Favored Glycine 0 N--CA 1.494 2.545 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.19 26.59 0.44 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.641 -1.505 . . . . 0.0 110.711 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 55.52 159.7 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.363 0 O-C-N 120.932 -1.105 . . . . 0.0 110.506 -179.765 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.604 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -162.88 -179.17 6.59 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.301 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.604 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 6.2 m -90.95 -50.22 5.99 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.764 -1.21 . . . . 0.0 108.808 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 175.26 -76.9 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.775 -0.578 . . . . 0.0 109.689 178.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -118.05 31.48 6.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.116 -0.99 . . . . 0.0 109.607 -179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.424 ' O ' ' C ' ' A' ' 13' ' ' TYR . 1.7 mmm -74.93 -4.98 41.34 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.26 -0.9 . . . . 0.0 109.44 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.424 ' C ' ' O ' ' A' ' 12' ' ' MET . 6.3 m-85 43.31 54.11 5.25 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.257 -0.902 . . . . 0.0 109.575 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.471 ' HB3' ' HG3' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -95.5 -20.55 18.94 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.228 -0.92 . . . . 0.0 109.129 179.766 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.4 m -56.89 121.73 10.59 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 122.588 1.185 . . . . 0.0 109.511 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -51.29 -36.15 41.08 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.011 -179.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.524 ' O ' HG23 ' A' ' 17' ' ' THR . 3.0 t -146.25 78.43 1.52 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.167 -0.958 . . . . 0.0 109.757 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 146.94 -170.94 27.78 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.691 -1.364 . . . . 0.0 109.691 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.405 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.0 OUTLIER -121.91 -162.29 0.98 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.258 -1.142 . . . . 0.0 109.074 179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 38.9 m -97.5 149.4 22.22 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.872 -1.142 . . . . 0.0 110.144 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.451 ' N ' ' O ' ' A' ' 24' ' ' LYS . 31.7 mtt180 -146.31 136.76 23.94 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 50.08 26.14 1.98 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.183 -0.948 . . . . 0.0 109.244 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.1 31.16 39.63 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.7 mtmt -145.33 157.81 43.96 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.295 -1.12 . . . . 0.0 110.067 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.51 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER -73.23 173.27 9.71 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.784 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.404 0 O-C-N 120.046 -1.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.7 p . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.352 0.596 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.532 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 1.9 mptt -94.58 160.22 14.73 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.39 -0.819 . . . . 0.0 109.586 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.659 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -112.07 169.55 13.17 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.536 ' HA ' ' CB ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -44.91 166.83 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.288 -1.125 . . . . 0.0 109.238 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 58.94 15.27 27.52 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.659 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -77.98 14.0 1.25 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.26 -1.141 . . . . 0.0 111.135 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER 30.19 45.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 CA-C-O 121.703 0.764 . . . . 0.0 110.4 178.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -54.47 -178.68 0.01 OUTLIER 'General case' 0 C--N 1.291 -1.944 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -179.558 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.597 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -91.6 -45.99 8.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.716 -1.24 . . . . 0.0 109.334 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 9' ' ' SER . 3.7 mtt180 178.63 -94.57 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.761 0 O-C-N 121.56 -0.713 . . . . 0.0 109.747 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.409 ' HA ' HD22 ' A' ' 11' ' ' LEU . 2.8 mm? -90.58 43.08 1.13 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.112 -0.993 . . . . 0.0 109.705 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.447 ' O ' ' OD1' ' A' ' 14' ' ' ASP . 2.9 mmt -75.75 -19.04 59.32 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.237 -0.914 . . . . 0.0 109.389 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 49.07 41.82 19.99 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.17 -0.956 . . . . 0.0 109.667 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.502 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 58.8 m-20 -102.69 -20.57 14.34 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.238 -0.914 . . . . 0.0 109.459 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 65.1 m -50.1 117.18 2.19 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 122.326 1.06 . . . . 0.0 110.332 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -48.91 -27.65 3.24 Favored 'General case' 0 C--N 1.29 -1.997 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.419 179.203 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.501 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 1.1 t -98.88 -118.55 0.14 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.476 -0.765 . . . . 0.0 109.742 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.501 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -71.65 -114.09 0.05 OUTLIER Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 p -128.35 -168.12 1.86 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.333 -1.098 . . . . 0.0 109.735 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.435 ' SG ' ' O ' ' A' ' 10' ' ' ARG . 38.3 m -69.32 150.6 47.18 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.339 -0.851 . . . . 0.0 109.991 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -128.54 123.59 33.87 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER 45.1 26.18 0.22 Allowed 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.576 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 99.97 -36.67 3.95 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.329 -1.508 . . . . 0.0 109.329 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.485 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 3.6 mtmm -92.01 141.27 28.8 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.224 -1.162 . . . . 0.0 109.104 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.536 ' CB ' ' HA ' ' A' ' 4' ' ' LYS . 1.7 m -56.74 176.02 0.11 Allowed 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.577 -0.702 . . . . 0.0 109.609 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.476 0 O-C-N 120.132 -1.605 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 16.3 p . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.295 0.569 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtp -116.84 174.38 6.12 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 121.19 -0.944 . . . . 0.0 110.004 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.432 ' O ' ' CB ' ' A' ' 25' ' ' CYS . . . -118.71 177.71 16.5 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.4 mtpt -60.48 147.61 40.61 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.08 -1.247 . . . . 0.0 110.063 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.93 -14.7 51.79 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.251 -1.54 . . . . 0.0 109.251 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.98 64.09 2.41 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.435 -1.038 . . . . 0.0 109.25 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.561 ' C ' ' O ' ' A' ' 6' ' ' ALA . 0.5 OUTLIER -11.49 128.33 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-O 121.802 0.81 . . . . 0.0 112.168 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.589 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.02 -178.51 3.52 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -179.685 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.589 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.83 -66.28 0.94 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 120.98 -1.075 . . . . 0.0 108.601 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.543 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ptt180 168.82 108.9 0.01 OUTLIER 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 7.2 mt 70.19 12.5 7.67 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.871 -0.518 . . . . 0.0 110.401 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.459 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 8.6 mtt -67.24 -29.61 69.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.097 -1.002 . . . . 0.0 109.117 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.5 m-85 64.74 65.95 0.6 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.424 -0.798 . . . . 0.0 110.223 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -118.62 -19.1 8.86 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -0.85 . . . . 0.0 109.134 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.5 m -60.59 123.95 18.92 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-O 122.495 1.14 . . . . 0.0 109.673 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -55.84 -41.55 74.46 Favored 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.702 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.8 89.41 2.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 109.528 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 133.03 -168.61 22.89 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -128.61 -167.37 1.76 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.138 -1.213 . . . . 0.0 109.682 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 35.2 m -84.5 96.37 9.11 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.189 -0.945 . . . . 0.0 109.682 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' N ' ' O ' ' A' ' 24' ' ' LYS . 11.1 ptp180 -102.84 137.19 41.38 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.95 -1.094 . . . . 0.0 108.913 179.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.85 19.04 10.31 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.154 -0.966 . . . . 0.0 109.116 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.18 -9.12 74.02 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 28.4 mtmt -111.74 173.21 6.46 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.171 -1.194 . . . . 0.0 109.764 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.432 ' CB ' ' O ' ' A' ' 3' ' ' GLY . 0.8 OUTLIER -73.62 164.55 26.5 Favored 'General case' 0 C--N 1.298 -1.639 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.334 179.746 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.583 0 O-C-N 120.081 -1.637 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.346 0.594 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.535 ' HD2' ' HB1' ' A' ' 6' ' ' ALA . 7.1 mmtm -131.08 169.11 16.32 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.183 -0.948 . . . . 0.0 110.437 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.84 166.46 14.8 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.026 -1.63 . . . . 0.0 109.026 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.463 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.5 pttm -50.21 154.85 1.09 Allowed 'General case' 0 C--N 1.306 -1.315 0 O-C-N 120.972 -1.31 . . . . 0.0 109.212 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.97 -20.31 36.94 Favored Glycine 0 N--CA 1.487 2.082 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.535 ' HB1' ' HD2' ' A' ' 2' ' ' LYS . . . -77.91 68.74 4.03 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.376 -1.073 . . . . 0.0 109.072 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 8.5 mttt -20.17 138.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 121.898 0.856 . . . . 0.0 112.38 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.605 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.39 -178.28 4.7 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 179.856 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.605 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 28.4 t -90.3 -73.35 0.53 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.737 -1.227 . . . . 0.0 108.13 178.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.823 ' O ' HD12 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -167.82 17.88 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.536 -0.727 . . . . 0.0 110.459 179.095 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.823 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 157.7 36.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.418 -0.801 . . . . 0.0 109.494 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.414 ' O ' ' C ' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -82.54 8.68 11.08 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 109.518 -179.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' HD23 ' A' ' 11' ' ' LEU . 8.0 m-85 44.28 49.51 7.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.532 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.497 ' O ' ' N ' ' A' ' 2' ' ' LYS . 6.0 p-10 -103.55 -35.3 8.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.211 -0.931 . . . . 0.0 109.534 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 4.0 m -61.11 125.14 22.65 Favored 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 122.349 1.071 . . . . 0.0 110.004 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -65.47 -33.19 75.36 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.884 179.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 1.3 t -117.94 -115.48 0.33 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.348 -0.845 . . . . 0.0 109.632 -179.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -42.82 165.5 0.02 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 -179.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.4 t -91.56 -174.46 3.89 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.308 -1.113 . . . . 0.0 109.555 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.2 m -61.18 105.18 0.46 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.324 -0.86 . . . . 0.0 109.46 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 24' ' ' LYS . 2.5 tmt_? -96.21 135.76 37.59 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.057 -1.027 . . . . 0.0 109.06 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.453 ' OG ' ' HD3' ' A' ' 21' ' ' ARG . 20.2 m 47.24 23.42 0.32 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.162 -0.961 . . . . 0.0 109.483 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.55 -20.26 49.35 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.596 -1.401 . . . . 0.0 109.596 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 4.8 mtmp? -101.72 148.5 25.19 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.252 -1.146 . . . . 0.0 109.716 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.463 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.1 m -57.41 163.91 2.11 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.33 -0.856 . . . . 0.0 109.472 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.39 0 O-C-N 119.916 -1.74 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.4 p . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.261 0.553 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 28.5 mmtm -112.55 164.77 12.91 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.4 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -104.74 167.34 15.29 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.493 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 1.2 tttp -52.0 153.03 2.81 Favored 'General case' 0 C--N 1.306 -1.285 0 O-C-N 121.141 -1.211 . . . . 0.0 110.086 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.5 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 60.74 3.92 3.7 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.54 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.94 20.66 0.76 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.805 -1.409 . . . . 0.0 110.903 -179.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.54 ' O ' ' O ' ' A' ' 6' ' ' ALA . 13.4 mtpt 52.66 123.34 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 122.688 1.232 . . . . 0.0 111.379 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.565 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -118.08 -178.47 3.51 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.121 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.565 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.3 OUTLIER -92.26 35.68 1.0 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.054 -1.029 . . . . 0.0 109.531 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.503 ' HB2' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 78.14 -54.83 0.5 Allowed 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.018 179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.93 43.21 0.97 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.088 -1.007 . . . . 0.0 109.711 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.549 ' HB2' ' HB2' ' A' ' 9' ' ' SER . 0.1 OUTLIER -93.54 -3.89 52.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.19 -0.944 . . . . 0.0 109.555 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 55.89 55.86 6.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.249 -0.907 . . . . 0.0 109.766 179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -102.89 -23.0 13.77 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.21 -0.931 . . . . 0.0 109.352 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.9 m -55.55 121.38 8.92 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 122.37 1.081 . . . . 0.0 109.629 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -48.07 -50.08 29.41 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.653 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.762 ' O ' HG23 ' A' ' 17' ' ' THR . 10.2 t -141.26 89.3 2.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.282 -0.886 . . . . 0.0 109.454 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.02 -173.42 28.07 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 m -121.35 -175.18 3.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.203 -1.175 . . . . 0.0 109.5 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.0 m -93.43 131.53 38.54 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.257 -0.902 . . . . 0.0 109.747 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 24' ' ' LYS . 39.2 ttp180 -119.6 119.78 34.77 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.322 -0.862 . . . . 0.0 109.235 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 59.03 15.38 3.97 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.352 -0.843 . . . . 0.0 109.577 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.04 -16.2 39.31 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.881 -1.287 . . . . 0.0 109.881 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 6.0 mtpt -94.98 154.57 17.12 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.232 -1.157 . . . . 0.0 109.468 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.415 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -70.21 178.87 2.62 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.037 -1.04 . . . . 0.0 109.494 -179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.493 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 119.92 -1.737 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.9 p . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 121.275 0.56 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 39.3 mmtt -119.05 -178.99 3.69 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.083 -1.011 . . . . 0.0 110.108 -179.378 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -140.4 163.25 26.45 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.72 149.34 0.62 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.914 -1.344 . . . . 0.0 109.643 -179.727 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 92.35 -39.41 3.01 Favored Glycine 0 N--CA 1.486 2.02 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.53 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.62 78.15 0.43 Allowed 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.365 -1.079 . . . . 0.0 108.145 178.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.9 ptpp? -34.8 159.56 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 121.416 0.627 . . . . 0.0 110.265 -179.229 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.592 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -138.84 -175.07 4.02 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -179.61 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.592 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -89.79 -47.29 8.0 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.688 -1.257 . . . . 0.0 108.696 -179.764 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.551 ' HG2' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 173.44 -73.09 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.762 0 O-C-N 121.533 -0.73 . . . . 0.0 110.302 178.634 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -118.28 58.37 0.82 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.02 -1.05 . . . . 0.0 110.279 -179.272 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.2 mmt -101.36 -14.6 17.53 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.037 -1.039 . . . . 0.0 108.7 178.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 50.37 68.21 0.8 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.396 -0.815 . . . . 0.0 109.925 179.606 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.42 ' HB3' ' CG ' ' A' ' 2' ' ' LYS . 3.9 m-20 -115.35 -21.5 9.82 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.223 -0.923 . . . . 0.0 108.79 179.238 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.6 m -60.15 123.06 16.01 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 122.627 1.203 . . . . 0.0 109.188 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.75 -32.84 14.62 Favored 'General case' 0 C--N 1.286 -2.193 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.25 -179.681 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 p -138.62 122.08 17.24 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.248 -0.907 . . . . 0.0 109.601 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.62 -156.83 26.02 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.745 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 20' ' ' CYS . 1.6 t -138.5 -179.8 6.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.274 -1.133 . . . . 0.0 109.357 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.496 ' N ' ' OG ' ' A' ' 19' ' ' SER . 19.6 m -59.21 111.2 1.26 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.254 -0.904 . . . . 0.0 109.526 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 24' ' ' LYS . 15.3 tpt180 -103.77 127.52 51.24 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.995 -1.065 . . . . 0.0 109.134 179.345 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.429 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 69.59 14.83 8.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.328 -179.684 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.38 -16.76 59.49 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.7 mtpt -114.05 175.55 5.42 Favored 'General case' 0 C--N 1.303 -1.421 0 O-C-N 121.229 -1.16 . . . . 0.0 109.63 -179.884 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -73.32 170.2 15.54 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.083 -1.047 . . . . 0.0 108.61 179.656 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.514 0 O-C-N 120.072 -1.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.3 p . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.208 0.528 . . . . 0.0 109.61 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 5.3 mmtm -107.73 166.93 10.32 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.293 -0.879 . . . . 0.0 109.945 179.91 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.89 -178.12 26.73 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -60.75 154.85 20.63 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.064 -1.256 . . . . 0.0 110.555 -179.585 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.419 ' HA2' ' HB2' ' A' ' 24' ' ' LYS . . . 45.91 18.47 0.26 Allowed Glycine 0 N--CA 1.494 2.526 0 N-CA-C 110.696 -0.962 . . . . 0.0 110.696 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.519 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.14 25.88 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.951 -1.323 . . . . 0.0 110.607 179.94 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.2 mtmp? 55.25 150.79 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 122.126 0.965 . . . . 0.0 111.266 179.918 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -156.68 177.08 11.89 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.623 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.553 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -92.0 -44.97 8.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.089 -1.007 . . . . 0.0 108.392 179.196 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.469 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 3.3 ttp180 168.17 -63.65 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.8 0 O-C-N 121.667 -0.645 . . . . 0.0 109.653 179.053 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 13' ' ' TYR . 0.4 OUTLIER -131.39 27.21 4.77 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.065 -1.022 . . . . 0.0 109.87 -179.878 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 1.4 mmt -66.5 -10.59 46.14 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.865 . . . . 0.0 109.787 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.648 ' CE1' HD23 ' A' ' 11' ' ' LEU . 12.5 m-30 55.84 59.77 3.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.203 -0.936 . . . . 0.0 109.402 -179.951 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.46 -24.05 10.39 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.231 -0.918 . . . . 0.0 109.404 179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.3 m -59.56 122.05 13.08 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 122.7 1.238 . . . . 0.0 110.056 -179.844 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -57.9 -20.29 35.99 Favored 'General case' 0 C--N 1.285 -2.217 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.743 179.673 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.428 ' O ' HG23 ' A' ' 17' ' ' THR . 2.9 t -154.57 123.62 6.33 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.232 -0.917 . . . . 0.0 109.517 179.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.7 175.31 50.68 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 179.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -169.62 1.67 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.294 -1.121 . . . . 0.0 109.599 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.7 m -75.25 146.48 41.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.152 -0.967 . . . . 0.0 109.446 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -135.33 117.03 14.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.287 -0.883 . . . . 0.0 109.483 179.958 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 7.3 t 71.12 4.51 5.1 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.487 -0.758 . . . . 0.0 109.655 -179.841 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.36 -1.36 28.03 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -123.37 176.3 6.22 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.348 -1.089 . . . . 0.0 109.191 179.841 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.44 176.22 7.0 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.416 -0.802 . . . . 0.0 109.684 179.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.36 0 O-C-N 119.88 -1.762 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.294 0.568 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.6 mmmm -106.47 -156.9 0.59 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.357 -0.839 . . . . 0.0 109.661 -179.794 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -157.31 165.09 33.23 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.893 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -45.63 153.96 0.23 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 120.941 -1.329 . . . . 0.0 109.822 -179.687 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.468 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 86.92 -42.35 3.15 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 108.773 -1.731 . . . . 0.0 108.773 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.508 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -67.73 73.55 0.17 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.43 -1.041 . . . . 0.0 108.253 178.964 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -35.26 158.19 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 121.555 0.693 . . . . 0.0 110.478 -178.82 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -130.11 -177.8 4.46 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.21 -0.996 . . . . 0.0 109.806 -178.618 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.572 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -91.77 34.96 0.97 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.311 -0.868 . . . . 0.0 109.725 -179.246 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.572 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 87.89 -75.62 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.638 179.347 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.99 42.88 2.71 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.905 -1.122 . . . . 0.0 110.714 -178.897 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.454 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -83.15 -21.8 33.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.95 -1.094 . . . . 0.0 108.586 179.16 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 56.96 71.87 0.55 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.546 -0.721 . . . . 0.0 110.071 179.436 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 2.2 m-20 -122.95 -15.26 7.42 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.282 -0.886 . . . . 0.0 109.725 179.709 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.4 m -67.6 122.3 17.74 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.559 1.171 . . . . 0.0 109.73 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.73 -43.12 47.52 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.362 179.895 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 18' ' ' GLY . 6.6 p -88.66 -116.26 0.06 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.047 -1.033 . . . . 0.0 109.645 -179.526 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.485 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.96 -144.56 0.01 OUTLIER Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -124.17 -148.89 0.41 Allowed 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.162 -1.199 . . . . 0.0 109.445 179.969 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.3 m -79.52 110.8 15.18 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.335 -0.853 . . . . 0.0 109.518 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.52 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -102.45 138.22 39.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 109.113 179.536 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.2 t 47.71 27.58 1.09 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.223 -179.646 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.4 -17.01 41.22 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -102.49 157.67 16.76 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.254 -1.145 . . . . 0.0 109.482 -179.906 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -64.71 169.8 4.71 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 118.831 -1.148 . . . . 0.0 108.305 179.186 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.463 0 O-C-N 119.98 -1.7 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.451 ' HB2' ' HA ' ' A' ' 16' ' ' CYS . 11.8 p . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.512 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 8.8 mmtt -128.26 173.14 10.4 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.048 -1.032 . . . . 0.0 110.514 -179.204 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -112.83 162.46 12.36 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.476 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -55.18 156.08 4.37 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 120.943 -1.327 . . . . 0.0 109.32 -179.911 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.39 -28.19 10.4 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.505 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -77.24 75.96 3.79 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 121.544 -0.974 . . . . 0.0 108.711 179.328 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.666 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -29.79 146.35 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 121.554 0.692 . . . . 0.0 110.766 -179.607 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.601 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -126.76 -175.2 3.34 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -179.549 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.601 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -90.42 -52.34 4.96 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 120.802 -1.186 . . . . 0.0 108.994 -179.897 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.538 ' CB ' ' O ' ' A' ' 9' ' ' SER . 31.5 ttm180 158.35 100.98 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.591 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 76.08 14.44 2.54 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.675 -0.641 . . . . 0.0 109.468 179.886 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.426 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mtp -61.23 -21.28 63.72 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.4 -0.812 . . . . 0.0 108.869 179.54 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.485 ' CD2' ' O ' ' A' ' 11' ' ' LEU . 53.8 m-85 60.3 68.63 0.75 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.313 -0.867 . . . . 0.0 109.891 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -127.18 -30.88 2.63 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.226 -0.922 . . . . 0.0 109.606 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.8 m -50.53 124.62 11.1 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.01 -1.057 . . . . 0.0 109.036 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -58.22 -27.84 64.31 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.13 -179.713 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.693 ' O ' HG23 ' A' ' 17' ' ' THR . 5.3 t -131.47 92.97 3.26 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.657 -179.638 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.76 -150.65 16.92 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.85 173.59 11.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.401 -1.058 . . . . 0.0 109.281 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.1 m -45.24 135.64 5.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.447 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.432 HH11 ' HG3' ' A' ' 21' ' ' ARG . 19.3 ttm-85 -115.94 118.59 33.37 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.251 -0.906 . . . . 0.0 109.377 179.787 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 44.88 25.35 0.15 Allowed 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.391 -0.818 . . . . 0.0 109.982 -179.916 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.65 -43.02 1.8 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 179.31 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.666 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -92.78 152.14 19.63 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.078 -1.248 . . . . 0.0 110.416 -179.125 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.491 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -67.61 170.2 8.11 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.397 -0.814 . . . . 0.0 109.203 179.788 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.531 0 O-C-N 119.972 -1.705 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.238 0.542 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 6' ' ' ALA . 9.4 mmtp -115.57 178.42 4.31 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.231 -0.918 . . . . 0.0 110.336 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.458 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -125.54 169.82 17.47 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.579 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.526 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -40.1 149.88 0.06 Allowed 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.362 -1.081 . . . . 0.0 110.213 -179.767 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 89.28 -42.71 3.02 Favored Glycine 0 N--CA 1.487 2.055 0 N-CA-C 108.726 -1.75 . . . . 0.0 108.726 -179.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 2' ' ' LYS . . . -64.99 74.79 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.4 -1.059 . . . . 0.0 108.605 179.335 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.27 150.31 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 CA-C-O 121.865 0.841 . . . . 0.0 111.116 -179.748 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -134.69 176.72 8.38 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.198 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.579 ' O ' ' C ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER -92.49 112.99 25.14 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.692 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.579 ' C ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -13.6 88.39 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.267 0 CA-C-O 121.443 0.64 . . . . 0.0 111.272 -179.005 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.533 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 2.0 tt 79.59 106.3 0.07 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.682 -0.636 . . . . 0.0 109.789 -179.689 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.566 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -159.63 -35.34 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.503 -0.748 . . . . 0.0 109.452 179.626 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.566 ' CD2' ' O ' ' A' ' 12' ' ' MET . 13.5 m-85 86.51 44.59 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.802 -0.561 . . . . 0.0 110.352 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.458 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 1.1 m-20 -102.4 -36.06 8.57 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.697 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.512 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 5.1 m -58.11 124.96 21.14 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.455 1.121 . . . . 0.0 108.733 179.106 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -58.17 -27.43 63.82 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.669 -179.613 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -144.07 -81.45 0.18 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.219 -0.926 . . . . 0.0 110.046 -179.628 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.512 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -41.12 163.87 0.01 OUTLIER Glycine 0 N--CA 1.493 2.455 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 -179.486 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.54 171.32 7.43 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -1.156 . . . . 0.0 109.718 -179.896 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 22.4 m -75.11 89.66 2.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.231 -0.918 . . . . 0.0 109.513 -180.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.9 mtt180 -108.42 142.01 39.42 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.013 -1.054 . . . . 0.0 109.631 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.34 37.35 18.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.409 -0.807 . . . . 0.0 108.936 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.73 9.8 47.13 Favored Glycine 0 N--CA 1.488 2.139 0 N-CA-C 109.243 -1.543 . . . . 0.0 109.243 -179.513 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 30.0 mtpt -117.99 141.06 48.86 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 121.292 -1.122 . . . . 0.0 110.342 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -56.13 171.21 0.27 Allowed 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.081 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.467 0 O-C-N 119.909 -1.745 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HD2' ' CB ' ' A' ' 6' ' ' ALA . 15.7 mmtt -126.35 171.57 10.86 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.329 -0.857 . . . . 0.0 110.237 -179.744 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.49 176.12 16.02 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.027 -1.629 . . . . 0.0 109.027 179.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -55.47 150.21 12.24 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.001 -1.293 . . . . 0.0 109.687 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.53 -28.27 16.24 Favored Glycine 0 N--CA 1.487 2.042 0 N-CA-C 108.185 -1.966 . . . . 0.0 108.185 -179.27 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.538 ' CB ' ' HD2' ' A' ' 2' ' ' LYS . . . -69.48 73.57 0.36 Allowed 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.679 -0.895 . . . . 0.0 108.671 179.214 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -31.84 150.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.188 0.518 . . . . 0.0 110.021 -179.768 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.559 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -163.58 -167.53 1.44 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.163 -0.961 . . . . 0.0 110.266 -179.44 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -93.53 -93.19 0.17 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.263 -0.898 . . . . 0.0 109.774 -179.532 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.8 OUTLIER -170.88 115.48 0.44 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.406 -0.809 . . . . 0.0 109.341 -179.748 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 80.37 13.99 0.84 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.624 -0.673 . . . . 0.0 109.346 -179.916 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.466 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -60.75 -21.79 63.37 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.31 -0.868 . . . . 0.0 109.212 179.84 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 12' ' ' MET . 3.6 m-85 63.9 52.28 2.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.432 -0.792 . . . . 0.0 110.261 179.448 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -121.65 -29.46 4.36 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.077 -1.015 . . . . 0.0 109.478 179.51 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 3.9 m -57.29 123.79 16.6 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-O 122.362 1.077 . . . . 0.0 109.382 179.792 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.3 OUTLIER -56.33 -28.42 58.86 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.909 -179.872 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 17' ' ' THR . 4.6 t -142.64 112.65 7.02 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.908 . . . . 0.0 109.372 -179.985 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 104.58 -144.41 15.82 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.1 p -151.39 176.68 11.03 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.186 -1.185 . . . . 0.0 109.778 -179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 7.9 m -88.7 103.47 15.98 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.383 -0.823 . . . . 0.0 109.322 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.532 ' O ' ' CB ' ' A' ' 22' ' ' SER . 44.2 mtp180 -116.64 143.26 45.84 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.312 -0.867 . . . . 0.0 109.303 -179.377 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.532 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 79.35 -36.26 0.17 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.386 -0.821 . . . . 0.0 109.926 -179.867 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.489 ' C ' ' HG3' ' A' ' 24' ' ' LYS . . . 143.77 -3.01 1.51 Allowed Glycine 0 N--CA 1.487 2.09 0 N-CA-C 110.176 -1.169 . . . . 0.0 110.176 179.928 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mtmt -141.46 148.64 39.83 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.706 -1.467 . . . . 0.0 110.764 -179.658 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.559 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 1.0 OUTLIER -55.48 165.51 0.79 Allowed 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.762 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.478 0 O-C-N 120.03 -1.669 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.474 ' C ' ' HD2' ' A' ' 2' ' ' LYS . 17.5 p . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.334 0.588 . . . . 0.0 109.804 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.589 ' CD ' ' N ' ' A' ' 2' ' ' LYS . 2.0 mptp? -105.13 178.42 4.57 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.422 -0.799 . . . . 0.0 109.915 -179.671 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.7 169.66 22.72 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 108.63 -1.788 . . . . 0.0 108.63 179.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.448 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 8.0 ptmt -53.07 154.33 3.07 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 120.914 -1.344 . . . . 0.0 109.038 -179.995 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.9 -26.87 12.53 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.898 -2.081 . . . . 0.0 107.898 -178.846 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -76.88 75.89 3.48 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.936 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -30.49 148.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.35 0.595 . . . . 0.0 110.243 -179.42 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.585 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -164.67 -162.24 0.63 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.042 -1.036 . . . . 0.0 110.057 -179.648 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.512 ' CB ' ' SD ' ' A' ' 12' ' ' MET . 1.0 OUTLIER -92.32 -141.14 0.2 Allowed 'General case' 0 N--CA 1.488 1.448 0 O-C-N 120.853 -1.154 . . . . 0.0 109.22 -179.567 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -103.05 -64.2 1.1 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.032 -1.042 . . . . 0.0 109.99 -179.566 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.01 50.08 0.87 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.172 -0.955 . . . . 0.0 110.135 -179.573 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.512 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -80.13 -36.66 34.95 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.148 -0.97 . . . . 0.0 109.034 179.379 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 12' ' ' MET . 29.8 m-85 61.47 48.14 6.12 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.424 -0.798 . . . . 0.0 110.066 179.461 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.473 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -110.04 -11.1 14.66 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.178 -0.951 . . . . 0.0 109.04 179.387 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.9 m -69.07 122.53 18.92 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 122.339 1.066 . . . . 0.0 109.281 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -46.88 -54.78 9.24 Favored 'General case' 0 C--N 1.287 -2.131 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.988 -179.817 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.8 t -133.51 54.75 1.93 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.131 -0.98 . . . . 0.0 109.454 -179.908 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -172.04 -158.06 15.32 Favored Glycine 0 N--CA 1.489 2.202 0 N-CA-C 109.374 -1.491 . . . . 0.0 109.374 179.938 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.6 m -143.03 170.07 16.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.173 -1.192 . . . . 0.0 109.683 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 9' ' ' SER . 64.1 m -93.5 85.32 4.89 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.479 -0.763 . . . . 0.0 108.998 179.767 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.528 ' O ' ' CB ' ' A' ' 22' ' ' SER . 31.8 ttp180 -100.25 134.04 43.78 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.616 -0.677 . . . . 0.0 109.558 -179.148 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER 79.56 -8.77 1.54 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.601 -0.687 . . . . 0.0 109.415 -179.517 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 116.69 -3.54 19.63 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.875 -1.155 . . . . 0.0 110.231 179.693 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.661 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -132.58 147.69 52.35 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.612 -1.523 . . . . 0.0 110.794 -179.487 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.585 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -55.73 170.92 0.24 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.21 179.874 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.43 0 O-C-N 119.836 -1.79 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.288 0.566 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -120.77 166.9 13.1 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.139 -0.975 . . . . 0.0 110.086 -179.77 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -102.69 162.98 16.35 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 -179.929 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.446 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.0 OUTLIER -54.31 161.81 1.25 Allowed 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.211 -1.17 . . . . 0.0 109.85 -179.774 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.83 18.28 1.8 Allowed Glycine 0 N--CA 1.492 2.378 0 N-CA-C 110.122 -1.191 . . . . 0.0 110.122 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -80.4 17.09 1.13 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.968 -1.313 . . . . 0.0 110.574 179.887 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.546 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER 52.68 129.26 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.388 0 CA-C-O 122.53 1.157 . . . . 0.0 111.559 179.449 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.569 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.4 p -167.58 -168.69 1.06 Allowed 'General case' 0 C--N 1.295 -1.799 0 O-C-N 121.564 -0.71 . . . . 0.0 110.3 179.714 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 m -93.38 -129.95 0.13 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.494 -0.754 . . . . 0.0 109.553 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.557 ' CZ ' ' HG3' ' A' ' 21' ' ' ARG . 16.6 tpt180 -137.77 109.67 7.18 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 120.807 -1.183 . . . . 0.0 109.419 -179.687 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.542 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 78.13 59.72 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.479 -0.763 . . . . 0.0 109.598 -179.993 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 46.4 mmm -118.28 -2.81 11.08 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 109.619 179.901 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 53.28 69.41 0.71 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.172 -0.955 . . . . 0.0 110.046 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -133.61 -29.86 1.32 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.327 -0.858 . . . . 0.0 109.772 179.559 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.443 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 5.6 m -60.42 121.12 11.3 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.452 1.12 . . . . 0.0 109.63 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -49.62 -35.57 21.55 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.108 -179.987 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.4 t -153.22 56.64 0.77 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.159 -0.963 . . . . 0.0 109.571 -179.898 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -175.25 -160.38 22.99 Favored Glycine 0 N--CA 1.489 2.214 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.58 173.85 10.7 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.303 -1.116 . . . . 0.0 109.325 179.992 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 8.2 m -111.81 91.89 3.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 109.345 179.86 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.557 ' HG3' ' CZ ' ' A' ' 10' ' ' ARG . 2.2 ttm180 -126.67 153.68 45.08 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.405 -0.809 . . . . 0.0 109.204 -179.458 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.3 OUTLIER 78.69 -35.15 0.17 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.335 -0.853 . . . . 0.0 110.111 -179.961 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.31 -4.96 1.36 Allowed Glycine 0 N--CA 1.486 2.021 0 C-N-CA 119.792 -1.194 . . . . 0.0 110.309 179.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -146.65 162.74 37.82 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 120.594 -1.533 . . . . 0.0 110.431 -179.914 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.569 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -56.91 174.77 0.15 Allowed 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.002 -179.548 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.446 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.305 -1.347 0 O-C-N 119.979 -1.7 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 14.7 p . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 121.297 0.57 . . . . 0.0 109.676 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 7.2 mmtt -122.72 172.68 8.25 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.306 -0.871 . . . . 0.0 110.413 -179.261 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -127.67 163.75 21.29 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 108.743 -1.743 . . . . 0.0 108.743 179.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.469 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 4.4 pttt -49.77 154.88 0.94 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 120.885 -1.362 . . . . 0.0 109.071 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.421 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.05 -31.51 6.57 Favored Glycine 0 N--CA 1.485 1.95 0 N-CA-C 107.766 -2.134 . . . . 0.0 107.766 -178.724 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.71 74.45 0.42 Allowed 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.909 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.02 148.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 121.386 0.612 . . . . 0.0 110.58 -179.369 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.567 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.9 OUTLIER -170.08 -169.37 0.85 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.871 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 20' ' ' CYS . 10.3 t -93.8 160.49 14.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.943 . . . . 0.0 109.927 -179.354 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.624 ' O ' HD12 ' A' ' 11' ' ' LEU . 10.1 ttp180 -72.42 71.45 0.93 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.337 -0.852 . . . . 0.0 109.348 179.869 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 159.45 -16.24 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.732 -0.605 . . . . 0.0 110.238 179.801 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.466 ' C ' ' O ' ' A' ' 11' ' ' LEU . 4.0 mmm -38.48 -47.19 1.25 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.378 -0.826 . . . . 0.0 109.697 -179.772 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 58.86 26.24 14.61 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 109.531 179.734 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD2' ' CE ' ' A' ' 12' ' ' MET . 71.7 m-20 -95.26 -6.32 41.67 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.088 -1.007 . . . . 0.0 109.2 179.611 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.5 m -60.9 126.47 27.5 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-O 122.478 1.132 . . . . 0.0 109.089 179.608 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.28 -22.91 0.28 Allowed 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.403 -179.578 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.458 ' O ' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -137.22 -85.88 0.31 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.942 -1.099 . . . . 0.0 110.052 179.867 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.487 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -57.23 -153.54 0.01 OUTLIER Glycine 0 N--CA 1.491 2.361 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.456 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.434 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 83.5 p -129.65 -166.04 1.61 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.317 -1.108 . . . . 0.0 109.812 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 25' ' ' CYS . 21.4 m -98.3 93.79 6.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.257 -0.902 . . . . 0.0 109.773 -179.711 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' O ' ' HB3' ' A' ' 22' ' ' SER . 27.4 ttp180 -112.97 156.58 22.79 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.552 -0.717 . . . . 0.0 109.33 -179.431 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.441 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 31.4 t 63.22 10.68 4.79 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.243 -0.911 . . . . 0.0 109.338 -179.78 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 94.58 -5.75 70.36 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.967 -1.111 . . . . 0.0 110.368 179.647 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.588 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.3 OUTLIER -136.07 154.54 50.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.675 -1.485 . . . . 0.0 110.93 -179.249 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.567 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.7 OUTLIER -55.61 176.56 0.06 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.066 179.587 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.409 0 O-C-N 119.946 -1.722 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.305 0.574 . . . . 0.0 109.628 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.3 mmtp -112.6 176.12 5.15 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.231 -0.918 . . . . 0.0 109.89 -179.687 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.407 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -113.78 159.08 13.89 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.175 -1.57 . . . . 0.0 109.175 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.449 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -52.47 159.0 1.09 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.24 -1.153 . . . . 0.0 110.075 -179.65 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 49.95 15.74 1.06 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.675 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.499 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -81.07 23.21 0.58 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.786 -1.42 . . . . 0.0 110.702 179.7 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.529 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER 55.34 154.67 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.177 -0.952 . . . . 0.0 110.729 -179.759 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 1.8 p 163.45 -168.37 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.554 -0.716 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.45 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 1.5 t -92.35 -139.11 0.18 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.45 -0.781 . . . . 0.0 109.561 -179.243 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.576 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.0 OUTLIER -137.74 114.48 10.55 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.023 -1.048 . . . . 0.0 109.722 -179.455 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.576 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER 86.92 6.67 0.28 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.087 0.47 . . . . 0.0 110.472 179.442 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.427 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -66.52 -30.1 70.35 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.99 -1.069 . . . . 0.0 108.364 178.962 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' A' ' 12' ' ' MET . 1.1 m-85 65.35 66.25 0.54 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.536 -0.728 . . . . 0.0 110.166 179.535 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 4.8 p-10 -124.65 -1.3 7.98 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.875 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.47 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 4.0 m -81.99 124.74 30.04 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 122.448 1.118 . . . . 0.0 110.275 -179.978 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -50.5 -23.59 2.59 Favored 'General case' 0 C--N 1.285 -2.231 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.359 178.618 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 17' ' ' THR . 9.7 t -153.85 129.73 10.18 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.632 -0.667 . . . . 0.0 109.22 179.548 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.0 -145.44 17.72 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.585 -1.406 . . . . 0.0 109.585 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 7.5 m -144.48 -161.35 1.27 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.264 -1.139 . . . . 0.0 109.216 179.984 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 1.3 m -119.71 85.9 2.46 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.139 -0.975 . . . . 0.0 110.129 -179.962 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -117.97 -176.28 3.01 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.769 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 48.27 23.36 0.54 Allowed 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.115 -0.991 . . . . 0.0 109.267 -179.937 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.3 6.96 76.89 Favored Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 179.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 6.0 mttt -146.49 160.53 41.98 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.871 -1.37 . . . . 0.0 110.705 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.544 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.5 OUTLIER -54.62 -173.92 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.773 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.442 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.306 -1.292 0 O-C-N 119.865 -1.772 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 15.1 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.9 mmtp -137.69 176.21 8.9 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.072 -1.017 . . . . 0.0 110.491 -179.439 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -119.98 175.68 15.96 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 108.767 -1.733 . . . . 0.0 108.767 179.579 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.443 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -57.34 153.55 12.18 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.801 -1.411 . . . . 0.0 109.196 179.888 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 99.22 -29.95 10.84 Favored Glycine 0 N--CA 1.486 1.974 0 N-CA-C 107.928 -2.069 . . . . 0.0 107.928 -178.994 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.93 74.13 0.45 Allowed 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.581 -0.952 . . . . 0.0 108.444 178.977 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.552 ' HA ' ' CB ' ' A' ' 24' ' ' LYS . 0.4 OUTLIER -32.51 152.48 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.407 0.622 . . . . 0.0 110.489 -179.442 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.558 ' SG ' ' N ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -169.76 -165.57 0.51 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.183 -0.948 . . . . 0.0 110.266 -179.614 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.439 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 39.7 m -92.76 -121.36 0.09 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.258 -0.901 . . . . 0.0 109.393 -179.424 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.508 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 12.8 mtm180 -143.23 115.48 8.45 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.678 -1.264 . . . . 0.0 109.415 -179.93 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.776 HD23 ' N ' ' A' ' 11' ' ' LEU . 1.3 mt 77.06 31.3 0.51 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.711 -0.618 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.496 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -78.92 -19.08 52.69 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 179.502 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.454 ' HB2' ' O ' ' A' ' 12' ' ' MET . 25.1 m-85 63.63 58.7 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.55 -0.719 . . . . 0.0 111.418 178.486 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.516 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -126.51 -14.81 5.73 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.945 -1.097 . . . . 0.0 109.717 179.095 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 3.2 m -73.51 129.37 37.83 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 122.296 1.045 . . . . 0.0 109.836 -179.943 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -60.87 -18.61 57.17 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.038 -179.743 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 18' ' ' GLY . 25.9 p -117.73 -111.56 0.34 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.113 -0.992 . . . . 0.0 109.257 -179.963 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -60.93 -150.15 0.01 OUTLIER Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 179.981 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 87.7 p -114.52 -165.98 1.06 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.345 -1.091 . . . . 0.0 109.65 -179.875 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' A' ' 25' ' ' CYS . 1.8 m -87.8 96.67 10.55 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.304 -0.872 . . . . 0.0 109.715 -179.979 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 -107.48 168.72 9.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.574 -0.704 . . . . 0.0 109.223 -179.679 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t 51.42 20.24 0.96 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.03 -1.044 . . . . 0.0 109.013 -179.52 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.466 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 78.35 2.77 84.79 Favored Glycine 0 N--CA 1.487 2.088 0 N-CA-C 109.773 -1.331 . . . . 0.0 109.773 -179.855 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.552 ' CB ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mttm -140.0 151.67 45.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.931 -1.335 . . . . 0.0 110.379 -179.813 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.558 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -54.82 175.1 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 119.91 -0.716 . . . . 0.0 109.41 179.816 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.412 0 O-C-N 119.989 -1.694 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.1 p . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.6 mmmt -114.07 171.43 7.61 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.168 -0.958 . . . . 0.0 110.372 -179.36 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -119.3 149.13 18.12 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.535 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.3 OUTLIER -44.79 158.4 0.06 Allowed 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.132 -1.216 . . . . 0.0 109.952 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 72.04 -2.75 24.76 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.569 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.02 23.26 0.47 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.923 -1.34 . . . . 0.0 111.054 -179.82 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.577 ' O ' ' CB ' ' A' ' 8' ' ' CYS . 1.4 ptmm? 46.93 175.64 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.537 -0.727 . . . . 0.0 109.66 -179.529 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.577 ' CB ' ' O ' ' A' ' 7' ' ' LYS . 3.7 p 150.8 -172.73 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 CA-C-O 121.394 0.616 . . . . 0.0 109.754 179.352 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.458 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 13.9 t -93.35 -132.42 0.15 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.854 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' CYS . 6.7 ptt180 -120.66 -24.65 5.69 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.732 -1.23 . . . . 0.0 109.861 179.999 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.476 HD12 ' CG ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -108.86 8.96 26.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.195 -0.941 . . . . 0.0 109.51 -179.968 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.456 ' SD ' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -46.26 -49.83 16.8 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.28 -0.888 . . . . 0.0 109.345 179.971 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 54.11 29.22 9.99 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 109.554 179.965 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.456 ' OD2' ' SD ' ' A' ' 12' ' ' MET . 29.6 m-20 -100.98 -4.66 27.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.359 -0.838 . . . . 0.0 109.479 179.858 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.7 m -64.68 124.24 21.4 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.331 1.062 . . . . 0.0 109.301 179.572 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -46.69 -49.75 18.93 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.954 -179.889 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -132.9 72.72 1.5 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.14 -0.975 . . . . 0.0 109.506 -179.916 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 158.58 -165.77 34.1 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.675 -1.37 . . . . 0.0 109.675 179.918 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.5 p -129.99 -175.29 3.57 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.275 -1.132 . . . . 0.0 109.194 179.889 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -108.82 114.0 27.41 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.309 -0.87 . . . . 0.0 110.019 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' A' ' 22' ' ' SER . 24.3 mtp180 -145.21 149.34 34.76 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -179.735 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' A' ' 21' ' ' ARG . 0.7 OUTLIER 80.07 -12.01 1.1 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.483 -0.761 . . . . 0.0 109.792 -179.564 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.48 ' O ' ' HG2' ' A' ' 24' ' ' LYS . . . 118.53 -3.93 15.3 Favored Glycine 0 N--CA 1.488 2.157 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.286 179.654 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.6 mtmt -146.54 164.55 32.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.732 -1.452 . . . . 0.0 111.417 -179.881 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.533 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -61.65 174.99 0.68 Allowed 'General case' 0 N--CA 1.491 1.577 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.771 -179.546 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.535 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.307 -1.271 0 O-C-N 119.935 -1.728 . . . . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_