data_2roo_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 2roo _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.543 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 25.5 p . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.99 129.94 9.82 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 4' ' ' LYS . 29.6 m -99.28 -170.48 1.92 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -1.114 . . . . 0.0 108.541 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' A' ' 3' ' ' SER . 48.4 tttm -46.87 128.73 11.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.555 -1.341 . . . . 0.0 107.565 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 62.09 79.36 0.26 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.361 -0.935 . . . . 0.0 108.635 -178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.55 129.97 0.1 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.246 -0.908 . . . . 0.0 109.927 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.772 ' HA ' ' O ' ' A' ' 29' ' ' SER . 45.4 t90 -53.27 138.47 32.16 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.424 0.63 . . . . 0.0 111.961 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.552 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -122.2 160.68 24.68 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.505 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.475 ' N ' ' OD2' ' A' ' 13' ' ' ASP . 18.3 tttt -85.78 -45.83 11.24 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.285 -0.884 . . . . 0.0 109.202 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.612 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 93.1 mt-10 -145.19 -167.34 2.65 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.661 0.744 . . . . 0.0 109.263 -179.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 tptt -62.67 -40.92 98.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.829 -0.545 . . . . 0.0 110.253 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -87.52 -3.07 59.0 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.112 -0.993 . . . . 0.0 110.761 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.612 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 24.8 t70 -80.93 -3.6 52.04 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.874 -1.141 . . . . 0.0 111.951 -177.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 34.2 m -86.09 145.08 27.2 Favored 'General case' 0 C--N 1.308 -1.233 0 O-C-N 120.298 -1.501 . . . . 0.0 108.862 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.543 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 72.5 m -51.39 161.67 0.43 Allowed 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 -179.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -58.33 137.55 57.11 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.41 4.3 87.98 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -130.95 141.53 50.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -1.205 . . . . 0.0 110.414 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 31.3 p-10 -104.36 166.91 10.09 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.936 -1.102 . . . . 0.0 109.181 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.8 t -102.81 130.69 49.88 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.239 -0.913 . . . . 0.0 109.569 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.05 128.55 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -79.3 123.75 27.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.082 -1.012 . . . . 0.0 109.121 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -101.57 74.2 1.5 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.285 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.1 p-90 -54.55 -36.06 63.91 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.094 -1.004 . . . . 0.0 109.786 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.64 -26.07 55.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.0 109.361 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.557 ' ND2' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -141.73 28.85 1.75 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.947 . . . . 0.0 108.897 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 23' ' ' ALA . 5.9 mp0 48.89 -171.0 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.523 -0.736 . . . . 0.0 109.23 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.46 ' O ' ' O ' ' A' ' 27' ' ' GLN . 4.0 mm-40 57.87 153.93 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.36 -0.838 . . . . 0.0 110.196 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.772 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 40.4 m -114.69 132.76 56.3 Favored 'General case' 1 C--O 1.148 -4.243 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.328 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.7 p -107.91 127.09 53.44 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.591 0.71 . . . . 0.0 110.75 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 79.9 m -71.66 148.92 46.03 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.443 -0.786 . . . . 0.0 110.263 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.501 ' O ' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -147.02 149.56 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.73 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.616 ' O ' ' CB ' ' A' ' 34' ' ' LYS . 10.4 ptt180 -51.93 -165.24 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.055 -1.028 . . . . 0.0 111.66 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.616 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 91.7 mttt . . . . . 0 N--CA 1.498 1.971 0 C-N-CA 123.592 0.757 . . . . 0.0 109.807 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.506 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 28.8 p . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.637 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -73.29 118.45 6.27 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 108.19 -1.964 . . . . 0.0 108.19 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.7 m -99.02 -161.21 0.86 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.306 . . . . 0.0 109.056 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -53.14 125.06 16.18 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 56.46 86.82 0.06 Allowed 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 178.52 135.25 0.08 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.771 0.796 . . . . 0.0 109.955 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.678 ' HA ' ' O ' ' A' ' 29' ' ' SER . 40.7 t90 -50.54 143.57 9.06 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.603 0.716 . . . . 0.0 111.061 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.63 148.37 46.51 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -95.24 -32.04 13.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.918 -1.114 . . . . 0.0 109.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.436 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 78.4 mm-40 -154.65 177.92 10.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.354 -0.841 . . . . 0.0 108.885 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -60.35 -48.86 79.94 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.466 ' C ' ' H ' ' A' ' 14' ' ' CYS . 16.4 ttmm -76.47 -35.03 58.66 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.741 -0.6 . . . . 0.0 111.128 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.436 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 7.8 m-20 -59.87 -1.3 0.27 Allowed 'General case' 0 N--CA 1.482 1.14 0 O-C-N 121.004 -1.06 . . . . 0.0 110.618 -178.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.655 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 47.9 t -90.58 147.68 23.18 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.021 -1.049 . . . . 0.0 108.753 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.506 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -58.1 139.83 53.94 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.217 -0.927 . . . . 0.0 109.677 -179.328 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 126.22 21.41 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.831 -0.747 . . . . 0.0 109.024 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.62 -6.78 24.33 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.655 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 86.0 m-85 -128.69 143.75 51.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.307 -1.114 . . . . 0.0 110.792 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.53 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 65.5 t30 -102.9 145.84 29.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.494 -0.754 . . . . 0.0 109.123 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.4 t -86.95 128.92 35.06 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.031 -1.043 . . . . 0.0 109.143 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 88.3 t -128.6 136.38 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.568 -0.707 . . . . 0.0 110.061 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -66.63 140.41 57.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.409 -0.807 . . . . 0.0 109.305 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.784 ' HB3' HD22 ' A' ' 26' ' ' ASN . . . -87.2 -142.58 0.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.519 -0.738 . . . . 0.0 110.27 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.518 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 8.9 p90 -172.22 -42.15 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.991 -0.683 . . . . 0.0 111.188 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.518 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -100.01 11.03 40.3 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.41 -1.432 . . . . 0.0 110.078 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 1.037 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -140.42 2.41 1.85 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.448 -0.783 . . . . 0.0 109.127 178.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.3 mm-40 46.79 34.21 2.49 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.089 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -122.57 -167.79 1.63 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.51 -0.744 . . . . 0.0 109.276 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.678 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.2 m -127.86 123.41 35.02 Favored 'General case' 0 C--O 1.181 -2.54 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 p -112.8 120.01 39.99 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.194 -0.941 . . . . 0.0 110.143 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -67.39 143.61 56.22 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.716 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -148.02 134.56 19.77 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.6 110.8 1.82 Allowed 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 46.5 pttt . . . . . 0 C--N 1.305 -1.365 0 O-C-N 120.973 -1.08 . . . . 0.0 111.286 -178.131 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.488 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 26.2 p . . . . . 0 N--CA 1.489 1.485 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.51 138.39 28.83 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 108.694 -1.762 . . . . 0.0 108.694 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.541 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 26.1 t -100.7 -138.63 0.33 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.281 -1.129 . . . . 0.0 108.701 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.541 ' N ' ' OG ' ' A' ' 3' ' ' SER . 12.7 tmtt? -61.39 128.43 36.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.675 -1.265 . . . . 0.0 107.745 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.682 ' N ' ' O ' ' A' ' 31' ' ' CYS . 45.0 ptt85 41.76 90.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 122.578 1.18 . . . . 0.0 108.92 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -169.59 139.15 2.0 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-O 122.039 0.923 . . . . 0.0 109.377 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.634 ' HA ' ' O ' ' A' ' 29' ' ' SER . 0.6 OUTLIER -47.07 131.63 12.42 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.713 0.768 . . . . 0.0 112.217 -177.603 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.587 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -121.09 152.32 38.82 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 177.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.61 ' HZ2' ' HE1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -98.6 -28.37 13.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.897 -1.127 . . . . 0.0 109.058 178.618 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.603 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 24.5 mt-10 -145.33 179.2 7.55 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-O 121.761 0.791 . . . . 0.0 109.825 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -61.26 -47.61 85.23 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.443 -0.786 . . . . 0.0 109.003 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 14' ' ' CYS . 85.1 tttt -83.56 -22.35 32.38 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.397 -0.815 . . . . 0.0 109.898 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.603 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 14.7 t70 -47.33 -11.88 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.019 -1.05 . . . . 0.0 109.882 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.547 ' N ' ' O ' ' A' ' 12' ' ' LYS . 59.9 m -83.25 133.57 34.99 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.475 ' C ' ' O ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -42.07 145.99 0.32 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.358 -0.839 . . . . 0.0 109.378 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -49.67 125.42 11.51 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.557 -0.714 . . . . 0.0 109.209 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.01 0.25 41.6 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -129.84 141.95 50.75 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.609 -0.936 . . . . 0.0 109.501 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.699 ' ND2' ' O ' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -103.56 158.89 16.05 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.212 -0.93 . . . . 0.0 109.24 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 39.1 t -92.37 112.67 24.7 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.763 -1.211 . . . . 0.0 110.031 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.49 ' O ' ' CB ' ' A' ' 29' ' ' SER . 75.5 t -89.28 132.07 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -81.02 124.53 29.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.245 -0.91 . . . . 0.0 109.292 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -114.03 118.63 34.64 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.949 0.88 . . . . 0.0 110.55 -179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.584 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -54.29 -11.95 0.58 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.521 ' CD1' ' O ' ' A' ' 25' ' ' TYR . 34.7 p90 -94.75 129.92 41.49 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.371 -1.456 . . . . 0.0 110.102 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.604 ' O ' ' C ' ' A' ' 27' ' ' GLN . 68.1 m-20 55.14 34.16 22.02 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.478 -0.764 . . . . 0.0 109.446 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.604 ' C ' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 29.44 43.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 122.261 1.029 . . . . 0.0 108.592 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.579 ' OE1' ' N ' ' A' ' 29' ' ' SER . 1.2 tm0? -111.36 163.62 13.79 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.634 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 14.6 m -125.8 148.33 49.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.185 -0.947 . . . . 0.0 110.473 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -108.44 117.21 33.57 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.63 -0.669 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.682 ' O ' ' N ' ' A' ' 5' ' ' ARG . 96.6 m -65.74 130.55 43.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.955 -1.091 . . . . 0.0 109.131 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.699 ' O ' ' ND2' ' A' ' 19' ' ' ASN . 95.5 mt-10 -146.98 135.09 21.54 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.966 -1.084 . . . . 0.0 110.639 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -74.92 107.45 7.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.402 -0.811 . . . . 0.0 110.183 178.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 O-C-N 120.563 -1.336 . . . . 0.0 111.461 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.547 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.4 p . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.01 141.15 35.53 Favored Glycine 0 N--CA 1.487 2.098 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.6 m -108.09 -152.96 0.49 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.378 -1.072 . . . . 0.0 109.207 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.07 118.83 4.35 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.098 -1.001 . . . . 0.0 108.588 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.519 ' HE ' ' CA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 53.96 91.55 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 122.087 0.946 . . . . 0.0 108.555 -178.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -175.77 125.7 0.22 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.844 0.83 . . . . 0.0 109.092 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.633 ' HA ' ' O ' ' A' ' 29' ' ' SER . 1.9 t90 -40.15 138.31 0.87 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.611 0.719 . . . . 0.0 110.856 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.724 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -111.57 140.28 46.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.6 tttm -86.71 -37.68 17.7 Favored 'General case' 0 C--N 1.294 -1.814 0 O-C-N 121.415 -0.803 . . . . 0.0 109.09 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.64 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 28.2 mt-10 -151.26 162.77 40.3 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.546 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -57.55 -32.64 67.31 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.104 -0.997 . . . . 0.0 108.611 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.5 -4.63 58.99 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.065 -1.022 . . . . 0.0 109.57 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.433 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -92.64 5.15 52.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.811 -1.181 . . . . 0.0 111.651 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.724 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 16.5 m -88.39 140.2 29.71 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.268 -1.52 . . . . 0.0 107.665 178.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 73.6 m -51.11 146.81 5.96 Favored 'General case' 0 N--CA 1.502 2.132 0 C-N-CA 117.078 -1.849 . . . . 0.0 110.407 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -52.01 118.63 3.59 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 121.195 -0.94 . . . . 0.0 110.259 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.05 -14.45 11.16 Favored Glycine 1 N--CA 1.534 5.167 0 C-N-CA 119.214 -1.47 . . . . 0.0 109.748 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -125.86 144.69 50.56 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.33 -1.1 . . . . 0.0 109.156 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.597 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 p-10 -108.64 175.73 5.36 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.039 -1.038 . . . . 0.0 109.404 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.64 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 1.6 m -90.5 135.84 33.44 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.851 -1.156 . . . . 0.0 110.472 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.63 100.56 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.453 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 24.3 t80 -67.32 126.14 28.32 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.12 -178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.15 100.83 13.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.275 -0.89 . . . . 0.0 108.931 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.486 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -50.17 -27.65 6.19 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 108.869 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.48 ' C ' ' H ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -99.41 149.5 23.12 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.496 ' OD1' ' O ' ' A' ' 26' ' ' ASN . 1.1 p30 51.29 12.47 0.14 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.968 -1.082 . . . . 0.0 108.852 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.48 ' H ' ' C ' ' A' ' 25' ' ' TYR . 97.1 mm-40 43.94 -148.81 0.06 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.512 -0.742 . . . . 0.0 109.119 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 27' ' ' GLN . 98.6 mt-30 60.39 134.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.264 -0.897 . . . . 0.0 110.214 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.633 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 34.2 m -96.89 170.47 9.14 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.456 -0.778 . . . . 0.0 109.537 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -141.21 129.69 22.56 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.321 -0.862 . . . . 0.0 109.431 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.597 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 96.5 m -72.27 131.27 42.47 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.615 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.409 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 1.0 OUTLIER -150.05 128.41 12.14 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.152 -0.968 . . . . 0.0 109.979 179.471 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.499 ' C ' ' CD ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.69 146.57 54.55 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.445 -0.784 . . . . 0.0 109.647 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.555 ' HZ2' ' ND2' ' A' ' 19' ' ' ASN . 42.1 mttt . . . . . 0 N--CA 1.485 1.278 0 O-C-N 121.248 -0.908 . . . . 0.0 110.48 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.582 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.6 p . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 7' ' ' TRP . . . -63.02 120.12 20.01 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.563 ' HG ' ' N ' ' A' ' 4' ' ' LYS . 10.9 t -96.69 -163.49 1.05 Allowed 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.181 -1.188 . . . . 0.0 108.744 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.563 ' N ' ' HG ' ' A' ' 3' ' ' SER . 15.7 tttp -45.47 121.59 3.09 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.187 -0.946 . . . . 0.0 108.604 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 56.66 86.89 0.06 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.15 152.43 1.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.337 -0.852 . . . . 0.0 110.865 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 8' ' ' CYS . 20.2 t90 -53.7 154.19 3.95 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.905 0.859 . . . . 0.0 112.213 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.629 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -132.11 136.01 46.83 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -87.95 -46.94 8.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.589 -1.319 . . . . 0.0 107.547 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.783 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 95.7 mt-10 -141.38 178.41 7.45 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.462 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.1 tttt -58.38 -45.98 87.25 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.516 -0.874 . . . . 0.0 109.432 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' NZ ' ' CB ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.04 -34.33 71.17 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.198 -0.939 . . . . 0.0 110.44 179.351 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.549 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 3.4 t70 -52.91 -6.76 0.06 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.292 -0.88 . . . . 0.0 112.045 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.711 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 12.7 m -86.47 146.46 26.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 120.404 -1.435 . . . . 0.0 108.904 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.582 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 71.0 m -52.87 137.05 33.07 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -46.03 122.97 4.19 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.396 -0.815 . . . . 0.0 109.753 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.61 -8.07 24.15 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -125.52 142.52 51.46 Favored 'General case' 0 C--O 1.286 2.989 0 O-C-N 121.092 -1.24 . . . . 0.0 111.829 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.495 ' ND2' ' N ' ' A' ' 20' ' ' CYS . 2.8 t30 -100.12 163.2 12.52 Favored 'General case' 0 N--CA 1.499 2.007 1 O-C-N 116.067 -4.145 . . . . 0.0 108.952 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.783 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 24.8 m -90.19 130.71 36.3 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 120.488 -1.382 . . . . 0.0 109.849 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -133.84 159.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.512 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 57.2 t80 -102.99 127.47 50.21 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.187 -0.946 . . . . 0.0 110.137 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.611 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -93.49 113.0 25.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.161 -0.962 . . . . 0.0 109.257 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.1 p-90 -53.89 1.73 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.323 -0.861 . . . . 0.0 110.74 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.611 ' H ' ' C ' ' A' ' 23' ' ' ALA . 36.2 p90 -123.91 148.24 47.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.991 -1.068 . . . . 0.0 109.224 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 54.51 17.22 1.55 Allowed 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.516 ' C ' ' O ' ' A' ' 26' ' ' ASN . 53.7 mm-40 24.94 65.08 0.05 Allowed 'General case' 0 N--CA 1.5 2.048 0 CA-C-O 121.12 0.486 . . . . 0.0 111.459 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.522 ' HB3' HD22 ' A' ' 26' ' ' ASN . 41.8 tt0 -132.42 155.68 48.06 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.232 -0.917 . . . . 0.0 109.742 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.612 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.4 m -90.17 118.64 29.85 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.3 t -103.98 124.24 48.65 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 120.963 -1.086 . . . . 0.0 111.184 -178.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 88.4 m -67.48 119.24 11.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.134 -0.978 . . . . 0.0 109.316 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.474 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 1.9 pt-20 -144.5 121.31 11.25 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -70.93 167.05 19.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.683 -1.261 . . . . 0.0 110.194 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.307 -1.26 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.503 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -81.03 132.69 11.4 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.475 ' O ' ' C ' ' A' ' 4' ' ' LYS . 21.7 m -104.45 -162.45 0.89 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.357 -1.084 . . . . 0.0 108.675 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.475 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.9 OUTLIER -44.25 130.93 6.3 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.649 -1.282 . . . . 0.0 108.096 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 mtp85 54.37 82.51 0.09 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.989 -1.069 . . . . 0.0 108.713 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 125.62 0.24 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.996 -1.065 . . . . 0.0 110.514 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.51 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.1 t90 -49.07 131.32 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.419 0.628 . . . . 0.0 111.078 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.525 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -117.87 153.17 33.99 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 178.26 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.656 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 6.8 tmtt? -94.77 -25.19 16.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.03 . . . . 0.0 108.718 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.525 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 5.9 pt-20 -165.65 -171.82 2.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.408 -0.807 . . . . 0.0 109.277 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.42 -45.25 94.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.301 -0.874 . . . . 0.0 109.229 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.9 tptp -70.39 -25.26 63.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.327 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.656 ' CG ' ' H ' ' A' ' 9' ' ' LYS . 11.5 t70 -63.75 -17.62 63.22 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.274 -0.891 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.1 m -83.57 122.17 28.2 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 119.943 -1.723 . . . . 0.0 107.961 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.537 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.99 -173.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 122.132 0.967 . . . . 0.0 111.418 -177.81 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.537 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.5 OUTLIER 22.08 -143.23 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.722 177.281 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -89.45 29.94 5.92 Favored Glycine 0 C--N 1.284 -2.348 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.597 ' CD1' ' HB2' ' A' ' 33' ' ' ARG . 91.4 m-85 -82.83 135.41 34.96 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.534 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 17.3 p-10 -99.07 149.0 23.46 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.951 -1.093 . . . . 0.0 109.391 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.445 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 15.2 t -90.89 126.27 36.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.148 -0.97 . . . . 0.0 110.152 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 66.7 t -120.25 130.95 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.487 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 14.5 t80 -78.12 122.41 25.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.906 -1.121 . . . . 0.0 109.025 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.59 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -98.38 88.66 4.2 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -7.67 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.099 -1.001 . . . . 0.0 109.469 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.59 ' H ' ' C ' ' A' ' 23' ' ' ALA . 3.4 m-85 -58.47 -46.69 86.1 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.082 -1.011 . . . . 0.0 109.864 -179.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.617 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -147.98 45.63 1.08 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.05 -1.031 . . . . 0.0 109.797 -179.597 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.487 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 96.6 mm-40 44.12 42.84 5.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.225 -0.922 . . . . 0.0 109.025 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -120.93 138.42 54.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.737 -0.602 . . . . 0.0 109.691 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.51 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 0.7 OUTLIER -95.62 112.95 24.56 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.293 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.0 t -98.52 114.98 27.59 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.042 -1.036 . . . . 0.0 110.831 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.0 m -67.89 145.22 54.8 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.262 -0.898 . . . . 0.0 109.183 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.534 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 97.8 mt-10 -146.46 107.45 4.16 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.987 -1.071 . . . . 0.0 112.077 -178.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.597 ' HB2' ' CD1' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -79.14 131.84 36.35 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.613 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt . . . . . 0 C--N 1.297 -1.69 0 O-C-N 120.699 -1.25 . . . . 0.0 108.44 178.916 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.756 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 11.0 p . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.068 0.461 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.565 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -66.14 -51.07 47.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.542 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 2.6 t 86.33 -169.2 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.471 0.653 . . . . 0.0 110.298 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.402 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 24.4 tttm -52.36 128.63 26.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.345 -0.847 . . . . 0.0 109.366 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttm-85 49.18 84.2 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.12 139.53 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.809 -0.757 . . . . 0.0 110.46 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.862 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.3 t90 -43.69 127.02 4.84 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.511 0.672 . . . . 0.0 110.878 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 29' ' ' SER . 22.0 p -123.98 133.61 53.65 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -91.82 -44.73 8.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.405 -1.434 . . . . 0.0 109.139 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -149.72 178.45 8.86 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -61.03 -47.61 85.64 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.59 -0.694 . . . . 0.0 109.989 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.625 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.26 -38.16 78.27 Favored 'General case' 0 C--N 1.292 -1.926 0 O-C-N 120.307 -1.495 . . . . 0.0 112.564 178.764 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 97.2 m-20 -66.98 -10.83 53.78 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.144 -0.972 . . . . 0.0 109.888 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 22.9 t -91.97 150.95 20.73 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.825 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.756 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.7 OUTLIER -61.89 135.88 57.75 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.38 143.25 6.68 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.761 -1.212 . . . . 0.0 109.039 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.19 -3.64 69.85 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.487 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 48.2 m-85 -125.92 141.28 52.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.297 -1.12 . . . . 0.0 111.284 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.531 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 12.5 p-10 -98.42 144.12 28.13 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 t -88.43 136.31 33.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.555 -0.716 . . . . 0.0 109.691 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.426 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 72.4 t -123.13 131.27 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -102.8 122.64 44.91 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.114 -0.991 . . . . 0.0 108.351 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.34 115.3 26.7 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.752 -1.218 . . . . 0.0 109.498 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.406 ' CD1' ' CD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -50.49 -27.19 6.12 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.623 -0.673 . . . . 0.0 110.06 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.956 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.1 p90 -99.23 164.5 12.11 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.003 -1.061 . . . . 0.0 110.175 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.956 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 45.78 13.6 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 CA-C-O 121.143 0.497 . . . . 0.0 110.339 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 25' ' ' TYR . 95.3 mm-40 34.0 46.3 0.14 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.616 -0.677 . . . . 0.0 111.04 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.633 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 tp60 -120.23 127.07 52.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.256 -0.903 . . . . 0.0 109.29 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.862 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.5 m -101.42 150.86 22.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 27.7 t -149.32 129.43 13.58 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.626 -1.296 . . . . 0.0 111.091 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.5 OUTLIER -73.22 159.95 32.67 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.289 -0.882 . . . . 0.0 111.453 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -146.09 159.03 43.85 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.323 -0.86 . . . . 0.0 110.142 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.564 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -60.76 132.48 54.02 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.699 0.761 . . . . 0.0 111.878 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 5.8 mmmt . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 120.919 0.39 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.614 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -52.98 122.6 21.23 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 108.926 -1.67 . . . . 0.0 108.926 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 14.7 t -102.23 -166.36 1.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -1.119 . . . . 0.0 109.466 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.498 ' N ' ' OG ' ' A' ' 3' ' ' SER . 0.5 OUTLIER -39.86 116.52 0.65 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.956 -1.09 . . . . 0.0 109.243 -179.406 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 59.97 86.32 0.1 Allowed 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.656 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.61 137.18 0.2 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.104 -0.997 . . . . 0.0 110.436 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.727 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.4 t90 -45.97 136.44 6.54 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.479 0.657 . . . . 0.0 111.94 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.97 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 2.4 p -134.11 152.29 51.77 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.655 -0.653 . . . . 0.0 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.7 mtmt -93.03 -49.26 6.1 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.769 -1.207 . . . . 0.0 108.289 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.572 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 34.2 mp0 -138.27 178.7 6.93 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.564 ' NZ ' ' OD1' ' A' ' 19' ' ' ASN . 0.7 OUTLIER -60.9 -43.58 98.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.793 -1.192 . . . . 0.0 108.187 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -65.89 -23.09 66.57 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.673 -0.642 . . . . 0.0 109.556 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.572 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 35.0 t70 -67.59 -16.09 63.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.157 -0.965 . . . . 0.0 110.701 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 83.5 m -84.81 127.33 34.08 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 120.789 -1.194 . . . . 0.0 108.128 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.568 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -57.69 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.774 0.797 . . . . 0.0 110.906 -178.452 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 13.0 t 19.6 -139.73 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 122.411 1.1 . . . . 0.0 111.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.532 ' N ' ' SG ' ' A' ' 16' ' ' CYS . . . -97.66 33.34 5.95 Favored Glycine 0 C--N 1.287 -2.177 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.444 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 78.3 m-85 -89.61 142.77 27.37 Favored 'General case' 0 C--N 1.288 -2.077 0 O-C-N 121.792 -0.828 . . . . 0.0 109.67 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.564 ' OD1' ' NZ ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -101.49 153.64 19.53 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.394 -0.816 . . . . 0.0 110.446 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.0 t -89.8 139.07 30.94 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.242 -0.911 . . . . 0.0 109.153 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -128.61 163.99 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.417 -0.802 . . . . 0.0 109.064 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.522 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 74.9 t80 -113.85 132.15 56.0 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.274 -0.891 . . . . 0.0 110.544 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -109.55 132.64 53.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.74 . . . . 0.0 110.02 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.424 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -56.9 -46.34 82.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.6 -0.688 . . . . 0.0 111.407 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.424 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -72.92 140.58 47.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.726 -1.233 . . . . 0.0 110.329 -178.226 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.658 ' O ' ' C ' ' A' ' 27' ' ' GLN . 18.9 m120 56.82 25.41 10.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.759 -0.588 . . . . 0.0 110.235 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.658 ' C ' ' O ' ' A' ' 26' ' ' ASN . 50.6 mm-40 21.78 49.25 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.607 ' N ' ' O ' ' A' ' 26' ' ' ASN . 8.8 tt0 -115.57 141.68 47.74 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.393 -0.817 . . . . 0.0 110.248 -178.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.727 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.0 m -92.7 142.85 26.9 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -129.58 133.22 47.06 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.267 -0.896 . . . . 0.0 110.858 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.97 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 99.2 m -70.77 144.07 50.99 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.43 -0.794 . . . . 0.0 110.808 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -151.31 135.52 16.76 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 4.2 tmm_? -58.77 143.55 46.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.22 -0.925 . . . . 0.0 110.285 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.505 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 O-C-N 121.511 -0.743 . . . . 0.0 110.025 178.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.725 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.394 0.616 . . . . 0.0 109.969 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.2 150.77 51.99 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 108.336 -1.906 . . . . 0.0 108.336 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . 8.1 t -95.41 -178.07 4.31 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.136 -1.214 . . . . 0.0 108.921 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.711 ' NZ ' HH21 ' A' ' 33' ' ' ARG . 31.7 tttp -47.76 120.84 3.62 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.512 ' HE ' HH22 ' A' ' 33' ' ' ARG . 9.5 mmt85 58.77 86.21 0.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 30' ' ' SER . . . -177.5 147.1 0.49 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.281 -0.887 . . . . 0.0 110.757 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.894 ' HA ' ' O ' ' A' ' 29' ' ' SER . 58.9 t90 -39.2 135.4 0.99 Allowed 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.944 0.878 . . . . 0.0 112.165 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.924 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 17.9 p -132.02 157.98 42.71 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.26 -42.54 8.49 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.727 -1.233 . . . . 0.0 108.896 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.48 ' CG ' ' OD2' ' A' ' 13' ' ' ASP . 2.5 pt-20 -158.21 -170.23 3.05 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -61.52 -43.31 99.09 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.604 -0.685 . . . . 0.0 111.602 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -85.84 -19.43 30.65 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.683 -1.261 . . . . 0.0 112.09 -177.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.716 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 1.1 m-20 -73.15 -0.53 14.42 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 120.507 -1.371 . . . . 0.0 110.793 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 20.6 m -90.58 144.29 25.91 Favored 'General case' 0 C--N 1.308 -1.205 0 O-C-N 120.492 -1.38 . . . . 0.0 109.221 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.564 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.06 125.1 19.06 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.382 -0.823 . . . . 0.0 109.494 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.564 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -28.15 130.3 0.06 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.257 0.551 . . . . 0.0 109.975 -179.672 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 103.02 -13.54 55.96 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -125.85 146.89 49.62 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.09 -1.241 . . . . 0.0 110.68 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.735 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 3.4 t30 -97.57 -166.86 1.44 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.8 t -138.12 130.54 29.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.424 -0.797 . . . . 0.0 109.044 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.3 t -139.38 154.95 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.367 -0.833 . . . . 0.0 110.137 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -75.39 126.36 30.86 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.516 -0.74 . . . . 0.0 109.618 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.08 109.68 21.77 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.286 -0.884 . . . . 0.0 110.574 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.468 ' C ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p90 -57.39 -9.5 1.07 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.285 -0.884 . . . . 0.0 111.238 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.438 ' HB3' ' ND2' ' A' ' 26' ' ' ASN . 15.4 t80 -59.78 -47.97 83.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.744 -1.223 . . . . 0.0 110.231 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.57 ' N ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -146.46 51.86 1.12 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.548 -1.345 . . . . 0.0 109.168 178.324 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 26' ' ' ASN . 26.5 mm-40 40.94 31.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.543 -0.723 . . . . 0.0 109.329 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.16 149.75 41.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.894 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.1 m -89.03 160.19 17.21 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.173 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 8.6 t -139.25 134.76 33.1 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.961 -1.087 . . . . 0.0 110.659 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.924 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 94.6 m -70.4 133.94 47.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.163 -0.961 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -150.22 144.45 25.63 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.807 -1.183 . . . . 0.0 110.353 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.711 HH21 ' NZ ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -56.52 163.21 1.85 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.483 -0.761 . . . . 0.0 110.444 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.308 -1.238 0 O-C-N 120.796 -1.19 . . . . 0.0 110.594 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.3 p . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.521 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -75.65 131.76 12.39 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 108.685 -1.766 . . . . 0.0 108.685 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 91.9 p -103.57 -145.23 0.37 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -1.081 . . . . 0.0 109.471 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -51.65 120.55 5.31 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.051 -1.031 . . . . 0.0 109.001 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.41 88.16 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.232 -0.918 . . . . 0.0 108.625 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 134.75 0.31 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.717 0.77 . . . . 0.0 109.939 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.86 ' HA ' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -44.74 148.79 0.48 Allowed 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.984 0.897 . . . . 0.0 111.929 -179.099 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.659 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -125.34 153.59 43.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.068 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.554 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 87.1 tttt -85.56 -33.69 21.66 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.554 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 7.3 mm-40 -164.54 -173.04 2.89 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-O 121.492 0.663 . . . . 0.0 109.632 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -62.79 -48.67 78.13 Favored 'General case' 0 C--O 1.184 -2.351 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.592 ' HZ1' ' CB ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -87.17 2.75 48.96 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 118.471 -1.292 . . . . 0.0 109.528 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.465 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 49.0 m-20 -93.29 4.24 54.31 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.678 -0.639 . . . . 0.0 111.97 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.659 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 1.3 m -84.57 155.94 21.85 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 120.297 -1.502 . . . . 0.0 107.167 179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 2' ' ' GLY . 89.0 m -47.2 166.75 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.916 -1.115 . . . . 0.0 109.215 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.61 130.45 44.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.198 -0.939 . . . . 0.0 110.106 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.77 8.04 85.0 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 32' ' ' GLU . 61.4 m-85 -119.3 148.03 43.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.101 -1.235 . . . . 0.0 110.888 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.2 t30 -118.71 157.23 27.87 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.445 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 16.0 t -91.22 132.47 36.09 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.934 -1.103 . . . . 0.0 110.739 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -121.33 131.79 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.62 126.1 26.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.123 -0.985 . . . . 0.0 108.907 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.74 108.87 18.05 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.432 -0.793 . . . . 0.0 109.513 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.52 ' CG ' ' N ' ' A' ' 25' ' ' TYR . 5.9 p-90 -53.92 -39.16 65.6 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.102 -0.998 . . . . 0.0 109.324 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' N ' ' CG ' ' A' ' 24' ' ' TRP . 11.5 p90 -71.5 141.57 50.16 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.327 -0.949 . . . . 0.0 108.904 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.456 ' OD1' ' OE1' ' A' ' 28' ' ' GLN . 1.0 OUTLIER 70.22 -4.68 1.49 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER 57.62 16.93 3.68 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.777 -0.824 . . . . 0.0 108.777 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.456 ' OE1' ' OD1' ' A' ' 26' ' ' ASN . 98.6 mt-30 -113.59 -172.06 2.01 Favored 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.548 -1.345 . . . . 0.0 108.55 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.86 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 50.1 m -121.01 138.43 54.17 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -103.31 139.8 38.26 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 121.424 -0.798 . . . . 0.0 111.234 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 87.9 m -70.92 152.0 44.11 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.377 -0.827 . . . . 0.0 109.653 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -147.57 -156.82 0.75 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.555 ' N ' ' OE1' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -156.85 126.73 6.3 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 122.316 1.055 . . . . 0.0 108.793 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt . . . . . 0 C--N 1.306 -1.293 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -178.361 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.479 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.442 0.639 . . . . 0.0 109.78 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.52 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -68.43 -51.23 32.9 Favored Glycine 0 N--CA 1.495 2.594 0 O-C-N 121.382 -0.824 . . . . 0.0 113.436 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.544 ' O ' ' C ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER 80.61 172.62 0.13 Allowed 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.075 -1.25 . . . . 0.0 110.244 -178.203 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.942 ' NZ ' ' HE ' ' A' ' 33' ' ' ARG . 46.4 tttp -28.77 129.56 0.07 Allowed 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.15 -0.969 . . . . 0.0 110.426 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 49.19 78.76 0.09 Allowed 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.52 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -171.39 135.87 0.97 Allowed 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.324 -1.35 . . . . 0.0 111.138 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.611 ' HA ' ' O ' ' A' ' 29' ' ' SER . 23.3 t90 -51.43 136.42 25.64 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.651 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.557 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -123.22 147.85 46.46 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 178.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.548 ' HB3' ' OD2' ' A' ' 13' ' ' ASP . 16.0 ttpt -88.94 -46.96 8.49 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.915 -1.115 . . . . 0.0 108.486 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.42 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 1.5 mm-40 -142.93 -179.36 6.31 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.483 ' CE ' ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -61.61 -36.05 79.6 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.678 -1.264 . . . . 0.0 110.181 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -80.72 -8.55 59.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.031 -1.043 . . . . 0.0 109.993 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.548 ' OD2' ' HB3' ' A' ' 9' ' ' LYS . 24.3 t0 -85.01 0.22 52.18 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.813 -1.179 . . . . 0.0 110.894 -179.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.557 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 5.3 m -88.64 142.87 27.33 Favored 'General case' 0 C--N 1.309 -1.193 0 O-C-N 120.121 -1.612 . . . . 0.0 108.028 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.53 ' SG ' ' HB2' ' A' ' 3' ' ' SER . 34.6 m -47.87 140.57 6.53 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.342 -0.849 . . . . 0.0 108.888 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.56 137.13 15.74 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.112 -0.993 . . . . 0.0 109.716 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.44 -0.73 78.18 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -124.83 144.95 50.02 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.29 -1.124 . . . . 0.0 110.063 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.516 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 t30 -100.24 153.61 19.13 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.473 -0.767 . . . . 0.0 110.127 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 41.9 t -91.15 114.58 27.15 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.537 0.684 . . . . 0.0 109.245 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.568 ' O ' ' HA ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -97.06 142.84 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.605 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -103.12 127.13 50.51 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.191 -0.943 . . . . 0.0 109.533 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.14 100.94 13.46 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.203 -0.936 . . . . 0.0 109.36 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.502 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 1.0 OUTLIER -44.14 -27.35 0.39 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.411 -0.806 . . . . 0.0 110.099 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.554 ' C ' ' H ' ' A' ' 27' ' ' GLN . 5.9 p90 -98.71 146.34 25.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.957 -1.089 . . . . 0.0 108.16 179.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 27' ' ' GLN . 1.1 m120 61.03 -3.43 0.16 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.359 -0.838 . . . . 0.0 109.348 -179.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.554 ' H ' ' C ' ' A' ' 25' ' ' TYR . 3.2 mp0 45.46 50.99 9.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.177 -0.952 . . . . 0.0 109.025 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.79 132.88 56.51 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.611 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 13.8 m -96.11 124.39 40.1 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.989 -1.069 . . . . 0.0 110.926 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.2 p -105.5 118.67 37.15 Favored 'General case' 0 C--N 1.31 -1.147 0 O-C-N 121.273 -0.892 . . . . 0.0 109.792 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.7 m -65.72 142.87 57.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.741 -1.224 . . . . 0.0 108.923 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -142.49 139.71 31.61 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.982 -1.074 . . . . 0.0 110.548 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.942 ' HE ' ' NZ ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -63.97 60.31 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.858 -0.526 . . . . 0.0 112.152 179.779 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.414 ' N ' ' O ' ' A' ' 32' ' ' GLU . 1.1 mmmp? . . . . . 0 N--CA 1.492 1.658 0 O-C-N 120.236 -1.54 . . . . 0.0 110.627 179.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.647 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.603 ' O ' ' HB3' ' A' ' 3' ' ' SER . . . -69.04 -59.19 6.06 Favored Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.925 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.603 ' HB3' ' O ' ' A' ' 2' ' ' GLY . 33.6 t 84.74 -165.28 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.785 -0.832 . . . . 0.0 110.549 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.405 ' N ' ' OG ' ' A' ' 3' ' ' SER . 68.6 tttt -51.64 132.2 30.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.626 -0.671 . . . . 0.0 109.318 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 53.37 78.6 0.14 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.435 ' HB1' ' C ' ' A' ' 2' ' ' GLY . . . -178.09 129.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.985 -1.072 . . . . 0.0 110.78 -178.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.476 ' HA ' ' O ' ' A' ' 29' ' ' SER . 38.4 t90 -52.78 117.52 2.99 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.511 -0.743 . . . . 0.0 110.219 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.648 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -109.32 150.66 27.68 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.731 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -92.5 -35.02 13.84 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.511 -1.368 . . . . 0.0 109.423 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.648 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -159.22 -170.16 2.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 109.029 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.7 tptm -60.64 -48.52 81.4 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.903 -1.123 . . . . 0.0 109.43 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -69.84 -41.99 74.19 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.542 -0.724 . . . . 0.0 111.678 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -54.29 -14.78 1.28 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.796 -1.19 . . . . 0.0 110.429 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.612 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 48.5 t -88.95 146.12 25.1 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.029 -1.044 . . . . 0.0 108.851 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.647 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.6 m -54.53 134.82 46.51 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.213 -178.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 123.96 16.23 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.25 -7.22 10.67 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.715 -1.754 . . . . 0.0 108.715 -179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.612 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 97.5 m-85 -125.38 150.98 46.73 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -1.067 . . . . 0.0 110.807 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.65 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 9.3 p-10 -96.57 133.1 41.48 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.0 t -93.4 125.93 38.26 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.354 -0.841 . . . . 0.0 109.763 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.517 ' CG1' ' O ' ' A' ' 21' ' ' VAL . 3.2 p -119.54 114.12 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -81.33 112.73 18.9 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.43 89.95 7.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.021 -1.049 . . . . 0.0 109.641 -178.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.687 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -47.11 -22.1 0.32 Allowed 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.814 -0.554 . . . . 0.0 110.903 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.448 ' H ' ' HD1' ' A' ' 24' ' ' TRP . 4.2 p90 -77.88 -45.18 24.96 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.516 -1.365 . . . . 0.0 111.267 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.938 ' ND2' ' H ' ' A' ' 28' ' ' GLN . 0.1 OUTLIER -103.64 9.2 37.43 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.366 -1.458 . . . . 0.0 109.721 178.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.575 ' N ' HD21 ' A' ' 26' ' ' ASN . 99.0 mm-40 57.3 15.07 2.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.607 -0.683 . . . . 0.0 111.245 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.938 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 77.4 mt-30 -119.07 138.66 52.72 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 120.961 -1.087 . . . . 0.0 109.909 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 4.3 m -96.2 131.16 42.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.032 -1.042 . . . . 0.0 109.612 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.3 t -117.43 104.15 10.82 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 121.439 -0.788 . . . . 0.0 109.957 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -64.59 153.92 37.83 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.833 -1.167 . . . . 0.0 110.056 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.65 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 94.6 mt-10 -144.12 137.3 27.4 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.363 -0.835 . . . . 0.0 110.177 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.626 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -73.13 85.35 1.35 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt . . . . . 0 N--CA 1.488 1.467 0 O-C-N 119.97 -1.707 . . . . 0.0 108.959 178.453 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.513 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 24.7 p . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.58 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -79.36 132.2 11.25 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.319 -1.419 . . . . 0.0 109.673 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 31' ' ' CYS . 6.7 p -111.37 -158.62 0.65 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.417 -1.049 . . . . 0.0 108.905 179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' A' ' 3' ' ' SER . 14.1 tttt -37.33 119.83 0.73 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.104 -0.998 . . . . 0.0 109.423 -179.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.411 ' N ' ' OE2' ' A' ' 32' ' ' GLU . 21.1 mtt180 50.74 87.55 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.442 ' HB1' ' N ' ' A' ' 3' ' ' SER . . . -172.23 131.52 0.62 Allowed 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.764 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.647 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.4 t90 -44.51 135.73 4.61 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.118 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.577 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -129.98 148.7 51.86 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -95.34 -43.46 8.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.791 -1.193 . . . . 0.0 109.492 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.72 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 14.8 mt-10 -135.67 164.46 27.81 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.317 -0.864 . . . . 0.0 109.076 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.427 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.4 ttpt -55.59 -30.58 61.1 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.067 -1.021 . . . . 0.0 109.176 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.04 -8.33 51.76 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.992 -1.067 . . . . 0.0 109.436 179.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.569 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 10.7 t70 -78.73 -3.6 45.07 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.89 -1.131 . . . . 0.0 110.152 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 7.5 m -85.78 141.29 29.78 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 120.623 -1.298 . . . . 0.0 107.958 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 62.3 m -49.03 144.76 4.52 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.165 -0.959 . . . . 0.0 109.702 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.19 136.45 15.21 Favored 'General case' 0 C--O 1.166 -3.309 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 95.82 -1.29 63.36 Favored Glycine 0 N--CA 1.491 2.36 0 C-N-CA 117.397 -2.335 . . . . 0.0 109.663 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -137.76 145.34 42.32 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.078 -1.248 . . . . 0.0 109.682 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.627 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.0 p-10 -103.21 176.43 5.15 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.549 1.166 . . . . 0.0 108.133 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 23.4 m -98.45 128.6 44.88 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 119.999 -1.688 . . . . 0.0 109.983 177.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.441 ' HB ' ' O ' ' A' ' 30' ' ' SER . 2.2 t -122.16 120.39 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.539 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 9.3 t80 -78.28 120.3 22.85 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.321 -0.862 . . . . 0.0 109.105 -178.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -97.35 108.82 21.63 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.801 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 6.0 p90 -56.26 121.61 9.91 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.128 -0.983 . . . . 0.0 109.57 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.801 ' HB2' ' O ' ' A' ' 24' ' ' TRP . 2.5 t80 157.81 -79.56 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.053 -1.029 . . . . 0.0 109.203 178.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -110.21 22.68 15.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.437 -0.789 . . . . 0.0 109.742 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.539 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 52.0 mm-40 54.9 47.32 22.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.255 -0.903 . . . . 0.0 108.721 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -115.93 131.79 56.84 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.647 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 63.6 m -94.52 122.65 37.32 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.988 -1.07 . . . . 0.0 109.838 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.441 ' O ' ' HB ' ' A' ' 21' ' ' VAL . 30.6 p -97.12 113.99 25.62 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.021 -1.049 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.627 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.6 m -64.52 134.18 53.92 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.826 -1.172 . . . . 0.0 109.464 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.504 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 69.8 mm-40 -142.35 141.81 32.38 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.375 -0.828 . . . . 0.0 110.715 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.751 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.53 43.46 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.023 -1.048 . . . . 0.0 111.012 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 32' ' ' GLU . 12.3 mmtm . . . . . 0 C--N 1.292 -1.909 0 O-C-N 120.236 -1.54 . . . . 0.0 110.049 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.524 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 14.7 p . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.11 0.481 . . . . 0.0 110.06 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.491 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -77.42 132.56 12.15 Favored Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.678 ' O ' ' C ' ' A' ' 4' ' ' LYS . 83.2 p -120.94 148.1 44.54 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.306 -1.114 . . . . 0.0 108.598 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.678 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER 4.77 113.27 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.454 0.645 . . . . 0.0 110.647 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.641 HH11 ' HB3' ' A' ' 5' ' ' ARG . 0.2 OUTLIER 60.22 87.15 0.09 Allowed 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 176.36 133.87 0.05 Allowed 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 110.114 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.767 ' HA ' ' O ' ' A' ' 29' ' ' SER . 24.3 t90 -51.44 130.05 26.58 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.505 0.669 . . . . 0.0 111.282 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.807 ' O ' ' HB2' ' A' ' 29' ' ' SER . 25.3 p -116.26 148.73 40.18 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -92.29 -46.19 7.83 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.408 -1.433 . . . . 0.0 109.123 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.429 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 1.3 mt-10 -154.11 -178.07 6.85 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -60.45 -43.53 96.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.596 -1.315 . . . . 0.0 109.755 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -71.53 -9.76 58.71 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.764 -1.21 . . . . 0.0 110.876 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.509 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 0.6 OUTLIER -99.46 8.71 44.33 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.921 -1.112 . . . . 0.0 110.078 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.621 ' SG ' ' CB ' ' A' ' 18' ' ' TYR . 16.3 t -101.25 135.11 43.27 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.422 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.0 OUTLIER -56.83 145.2 30.3 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.938 -1.101 . . . . 0.0 109.982 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.0 m -49.48 138.14 13.95 Favored 'General case' 1 C--O 1.152 -4.036 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.22 2.08 68.83 Favored Glycine 0 C--N 1.304 -1.243 0 N-CA-C 108.654 -1.778 . . . . 0.0 108.654 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.621 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 90.5 m-85 -137.11 149.39 47.3 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.503 -0.998 . . . . 0.0 110.545 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.727 HD22 ' HZ1' ' A' ' 34' ' ' LYS . 4.5 p-10 -108.64 163.16 13.49 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.482 -0.762 . . . . 0.0 109.528 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 t -106.21 134.15 49.8 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.228 -0.92 . . . . 0.0 110.033 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.1 p -138.82 141.46 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.145 -0.972 . . . . 0.0 109.701 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -84.41 127.18 33.86 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.061 -1.024 . . . . 0.0 110.508 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -95.6 95.06 8.11 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.442 -0.787 . . . . 0.0 109.434 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.514 ' O ' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -53.49 -40.55 65.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.415 -0.803 . . . . 0.0 110.766 -179.393 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 23' ' ' ALA . 51.4 p90 -63.01 -46.37 87.97 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.604 -1.31 . . . . 0.0 110.488 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.477 ' C ' ' H ' ' A' ' 28' ' ' GLN . 12.7 m-20 -92.88 1.53 57.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.86 -1.15 . . . . 0.0 109.23 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 24' ' ' TRP . 99.4 mm-40 56.53 6.3 0.27 Allowed 'General case' 0 C--O 1.158 -3.754 0 CA-C-O 123.998 1.856 . . . . 0.0 111.771 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.477 ' H ' ' C ' ' A' ' 26' ' ' ASN . 30.1 mt-30 -117.89 154.89 31.11 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 113.623 -1.626 . . . . 0.0 107.875 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.807 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.8 m -91.07 159.54 16.07 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 120.95 -1.094 . . . . 0.0 110.175 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -143.03 134.81 26.7 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 121.097 -1.002 . . . . 0.0 110.456 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 3.4 m -68.89 148.71 49.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.396 -0.815 . . . . 0.0 109.573 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.479 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 44.4 mm-40 -141.63 145.65 35.26 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.845 -1.159 . . . . 0.0 111.676 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.65 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -69.76 92.52 0.68 Allowed 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.09 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.727 ' HZ1' HD22 ' A' ' 19' ' ' ASN . 56.9 mttp . . . . . 0 C--N 1.304 -1.382 0 O-C-N 120.289 -1.507 . . . . 0.0 108.604 178.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 3' ' ' SER . 19.4 p . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 121.231 0.538 . . . . 0.0 109.83 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.498 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -53.86 89.11 0.01 OUTLIER Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.607 ' O ' ' O ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -110.95 104.0 12.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.246 -1.149 . . . . 0.0 109.479 -179.081 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.607 ' O ' ' O ' ' A' ' 3' ' ' SER . 33.5 tttt 49.39 108.96 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.925 0.869 . . . . 0.0 109.205 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.52 ' HG3' ' HG2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 50.78 83.39 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.263 -0.898 . . . . 0.0 108.61 -178.84 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.93 120.54 0.06 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.753 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.8 t90 -48.95 142.35 6.65 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.491 -0.756 . . . . 0.0 111.482 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.462 ' N ' ' CD1' ' A' ' 7' ' ' TRP . 3.0 p -125.64 148.72 48.89 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.439 ' HB3' ' CB ' ' A' ' 13' ' ' ASP . 81.1 tttt -86.01 -28.18 24.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.093 -1.005 . . . . 0.0 108.832 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.775 ' HG3' ' H ' ' A' ' 11' ' ' LYS . 19.2 tp10 -170.28 -157.35 0.15 Allowed 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.775 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 6.3 tmtt? -69.39 -49.03 59.18 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.356 0.598 . . . . 0.0 109.659 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.42 ' HA ' ' HZ2' ' A' ' 11' ' ' LYS . 16.7 tttm -69.29 -45.56 69.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.441 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.534 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 9.9 t70 -53.83 -9.05 0.2 Allowed 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.463 -0.773 . . . . 0.0 110.535 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.71 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -94.19 150.54 20.22 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.914 -1.116 . . . . 0.0 108.342 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.731 ' O ' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER -60.54 133.77 56.42 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.24 -0.913 . . . . 0.0 110.955 -178.379 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -48.78 66.46 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 CA-C-O 121.533 0.682 . . . . 0.0 110.954 179.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.731 ' N ' ' O ' ' A' ' 15' ' ' CYS . . . 179.05 -29.17 0.06 OUTLIER Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.206 -1.958 . . . . 0.0 108.206 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.71 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 94.1 m-85 -108.29 153.75 22.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.707 -0.878 . . . . 0.0 110.19 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.712 ' C ' ' SG ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -101.83 134.09 45.55 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.55 -0.719 . . . . 0.0 109.263 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.7 t -80.52 121.51 25.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.985 -1.072 . . . . 0.0 109.938 -179.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.442 ' CG2' ' OD1' ' A' ' 19' ' ' ASN . 41.4 t -126.55 132.56 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.517 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 62.2 t80 -70.97 131.31 43.5 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.399 178.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.824 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -86.18 81.5 8.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 120.988 -1.07 . . . . 0.0 108.956 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.564 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -54.34 -36.83 64.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.272 -0.892 . . . . 0.0 111.123 -178.934 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.781 ' CE2' ' ND2' ' A' ' 26' ' ' ASN . 51.0 p90 -71.93 -27.08 62.57 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.648 -1.282 . . . . 0.0 110.997 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.781 ' ND2' ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -133.56 13.13 4.11 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.776 -1.202 . . . . 0.0 109.121 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.824 ' N ' ' O ' ' A' ' 23' ' ' ALA . 79.4 mm-40 63.93 -163.41 0.26 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.436 0.636 . . . . 0.0 110.724 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 59.93 -174.5 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.318 -0.864 . . . . 0.0 109.487 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.753 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 3.2 m -132.67 121.77 23.64 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.235 -0.916 . . . . 0.0 108.856 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -114.62 113.28 24.16 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.218 -0.926 . . . . 0.0 109.966 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.712 ' SG ' ' C ' ' A' ' 19' ' ' ASN . 0.7 OUTLIER -67.01 146.51 54.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.419 -0.913 . . . . 0.0 110.299 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -142.06 152.31 43.21 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.292 -0.88 . . . . 0.0 109.441 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.59 153.08 1.75 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.854 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.306 -1.295 0 O-C-N 120.779 -1.201 . . . . 0.0 109.611 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 15.8 p . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.558 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -76.19 149.84 38.03 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 119.517 -1.325 . . . . 0.0 110.422 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.693 ' O ' ' N ' ' A' ' 5' ' ' ARG . 3.9 m -110.13 -162.57 0.81 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.275 -1.133 . . . . 0.0 109.861 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.756 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 3.6 tttm -58.53 54.23 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.5 -0.75 . . . . 0.0 110.327 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.693 ' N ' ' O ' ' A' ' 3' ' ' SER . 33.7 ptt-85 137.55 76.59 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.662 0.744 . . . . 0.0 109.144 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.0 146.77 0.89 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.187 -0.946 . . . . 0.0 110.512 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.734 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.1 t90 -47.83 151.11 0.95 Allowed 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.185 0.993 . . . . 0.0 111.746 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER -121.98 153.58 38.35 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.047 -179.597 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -110.8 -29.51 7.94 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.992 -1.067 . . . . 0.0 109.057 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.621 ' HG2' ' H ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -168.79 -173.23 1.8 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.336 -0.852 . . . . 0.0 109.28 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.621 ' H ' ' HG2' ' A' ' 10' ' ' GLU . 6.6 ttmt -66.59 -49.45 66.3 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.199 -0.601 . . . . 0.0 112.187 -178.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -83.95 -10.81 57.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.476 -1.39 . . . . 0.0 109.054 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.433 ' HB2' ' N ' ' A' ' 10' ' ' GLU . 50.3 m-20 -71.78 -3.88 24.58 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.89 179.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 30.5 t -85.56 149.62 25.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.872 -1.142 . . . . 0.0 108.773 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 64.7 m -57.05 147.65 23.71 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.352 -0.843 . . . . 0.0 109.324 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -52.32 134.15 34.11 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.396 -0.815 . . . . 0.0 109.225 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.47 -0.99 66.12 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.625 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 79.7 m-85 -134.17 150.25 51.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.234 -1.156 . . . . 0.0 110.55 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.04 150.82 25.38 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 2.8 m -94.0 138.27 32.28 Favored 'General case' 0 N--CA 1.403 -2.823 1 O-C-N 116.281 -4.012 . . . . 0.0 109.931 175.494 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.1 t -135.12 137.96 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.447 -0.783 . . . . 0.0 110.824 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.4 103.83 1.39 Allowed 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.696 ' O ' ' C ' ' A' ' 24' ' ' TRP . . . -93.76 -161.74 0.88 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.731 ' C ' ' H ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 14.07 94.93 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.95 0.881 . . . . 0.0 109.47 -178.977 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -49.26 3.42 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.68 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.845 HD21 ' H ' ' A' ' 26' ' ' ASN . 0.1 OUTLIER -81.34 -56.03 4.32 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.277 -0.889 . . . . 0.0 108.824 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.741 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 172.72 37.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.224 1.011 . . . . 0.0 108.652 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.439 ' HB3' ' HB2' ' A' ' 24' ' ' TRP . 56.4 tp60 -121.57 157.38 30.86 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.586 -1.321 . . . . 0.0 110.547 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.734 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 2.6 m -133.32 150.57 51.86 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 t -143.5 136.44 27.65 Favored 'General case' 0 C--N 1.309 -1.185 0 O-C-N 121.078 -1.013 . . . . 0.0 110.529 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 1.5 m -67.09 144.36 56.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.448 -0.783 . . . . 0.0 109.641 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -148.17 139.07 23.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.553 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.545 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -57.94 175.41 0.2 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.121 -0.987 . . . . 0.0 109.384 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.545 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 O-C-N 120.623 -1.298 . . . . 0.0 109.925 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.564 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 22.0 p . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.645 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -76.6 122.61 6.41 Favored Glycine 0 N--CA 1.486 2.014 0 C-N-CA 118.669 -1.729 . . . . 0.0 108.929 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.697 ' O ' ' C ' ' A' ' 4' ' ' LYS . 14.9 m -98.97 175.21 6.0 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.285 . . . . 0.0 108.148 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.697 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER -25.72 128.38 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.176 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 4' ' ' LYS . 14.4 ttp180 60.33 82.19 0.16 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.224 -0.923 . . . . 0.0 109.134 -178.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HB1' ' O ' ' A' ' 5' ' ' ARG . . . 176.44 129.02 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.226 -0.921 . . . . 0.0 110.582 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.568 ' HA ' ' O ' ' A' ' 29' ' ' SER . 2.0 t90 -44.66 133.25 6.04 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.572 0.701 . . . . 0.0 110.565 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.681 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 27.6 p -114.12 135.23 54.26 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -90.03 -37.04 14.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.618 -1.301 . . . . 0.0 109.487 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.429 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 0.2 OUTLIER -146.37 177.85 8.7 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.3 -0.875 . . . . 0.0 108.846 178.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -61.4 -45.5 94.09 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.328 0.585 . . . . 0.0 110.074 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -81.06 -15.52 55.83 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 119.667 -1.895 . . . . 0.0 112.214 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.429 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -71.81 -7.79 50.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.105 -0.997 . . . . 0.0 111.243 -178.286 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.51 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 51.3 m -88.13 142.79 27.48 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.446 -1.409 . . . . 0.0 107.758 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.496 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -53.09 148.97 7.27 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.542 -178.523 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -49.17 120.19 3.82 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.134 0.968 . . . . 0.0 109.746 -178.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.94 -1.27 35.74 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 4' ' ' LYS . 82.7 m-85 -131.15 144.82 51.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.449 -1.03 . . . . 0.0 108.587 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.573 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 9.2 p-10 -118.31 169.08 10.03 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.028 -1.045 . . . . 0.0 110.333 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.1 t -89.45 128.42 35.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.667 -0.645 . . . . 0.0 109.436 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.5 t -127.71 130.74 70.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.367 -0.833 . . . . 0.0 109.459 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -72.79 118.38 15.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.181 -0.949 . . . . 0.0 109.066 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.94 95.16 10.1 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.412 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p-90 -52.87 -40.46 63.45 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.523 -0.736 . . . . 0.0 110.517 -178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.642 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.4 OUTLIER -73.9 136.56 43.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.854 -1.154 . . . . 0.0 108.606 179.873 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER 55.95 13.22 1.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.28 -0.888 . . . . 0.0 109.07 -178.389 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.425 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 2.0 mp0 50.51 -155.53 0.12 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.408 -0.808 . . . . 0.0 109.888 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.894 HE21 ' H ' ' A' ' 29' ' ' SER . 1.7 tp60 63.56 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.261 -0.899 . . . . 0.0 110.062 -179.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.894 ' H ' HE21 ' A' ' 28' ' ' GLN . 70.6 m -100.9 157.03 17.03 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.334 178.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.6 t -136.69 139.06 41.69 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.233 -0.917 . . . . 0.0 110.653 -179.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.681 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 91.3 m -66.87 148.24 52.2 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.494 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 4.6 pt-20 -144.25 139.69 28.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.972 -1.08 . . . . 0.0 108.982 178.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 33' ' ' ARG . 3.9 ttm180 -64.21 155.01 33.15 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.311 -0.868 . . . . 0.0 110.735 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.3 -1.58 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.719 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.674 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -73.57 150.17 42.9 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.464 ' O ' ' C ' ' A' ' 4' ' ' LYS . 50.2 m -105.26 -170.2 1.71 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.355 -1.085 . . . . 0.0 109.505 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.464 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.6 OUTLIER -37.52 121.84 0.89 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.219 -0.925 . . . . 0.0 109.91 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.612 ' N ' ' O ' ' A' ' 31' ' ' CYS . 42.5 ttp180 48.89 86.05 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 178.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.476 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -173.03 124.23 0.42 Allowed 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 121.975 0.893 . . . . 0.0 109.668 -178.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.683 ' HA ' ' O ' ' A' ' 29' ' ' SER . 34.7 t90 -24.54 142.67 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.21 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.661 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -130.95 157.08 43.91 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.731 0.777 . . . . 0.0 110.574 179.379 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.468 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 30.5 mttm -88.49 -40.82 13.16 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 177.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 51.1 mm-40 -159.41 -173.65 4.28 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 121.541 0.686 . . . . 0.0 109.173 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.555 ' HG3' ' OD1' ' A' ' 19' ' ' ASN . 53.5 tttm -67.94 -45.82 73.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.363 -0.836 . . . . 0.0 109.986 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -12.83 60.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.529 -0.732 . . . . 0.0 110.099 -178.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.431 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 12.4 m-20 -85.4 2.58 43.82 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.045 -1.034 . . . . 0.0 111.549 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.525 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 3.8 m -85.38 143.38 28.67 Favored 'General case' 0 C--N 1.308 -1.237 0 O-C-N 120.428 -1.42 . . . . 0.0 108.408 179.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.719 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 11.0 m -54.56 138.92 39.69 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.323 -0.861 . . . . 0.0 108.708 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 44.4 t -34.12 148.49 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.94 1.38 62.53 Favored Glycine 0 N--CA 1.493 2.44 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.3 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.645 ' HB3' ' HB3' ' A' ' 31' ' ' CYS . 62.8 m-85 -135.93 156.57 48.57 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.5 -1.589 . . . . 0.0 111.157 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 1.055 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 32.1 t30 -131.05 169.24 16.13 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.727 . . . . 0.0 110.391 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.413 ' N ' ' CG ' ' A' ' 19' ' ' ASN . 6.3 t -90.35 109.08 20.2 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.915 -1.116 . . . . 0.0 109.94 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -103.58 134.22 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.493 -0.754 . . . . 0.0 109.797 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.536 ' CD2' ' O ' ' A' ' 23' ' ' ALA . 65.4 t80 -67.91 141.49 56.35 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.044 -1.035 . . . . 0.0 108.966 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.536 ' O ' ' CD2' ' A' ' 22' ' ' TYR . . . -85.52 -148.82 0.12 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.299 -0.876 . . . . 0.0 110.01 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.416 ' CZ3' ' O ' ' A' ' 22' ' ' TYR . 0.8 OUTLIER -175.01 -49.0 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.253 -179.336 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.579 ' CE1' ' ND2' ' A' ' 26' ' ' ASN . 4.2 p90 -86.78 -34.29 19.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.61 -1.307 . . . . 0.0 108.375 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.812 HD21 ' H ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -109.57 10.34 25.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.478 -0.764 . . . . 0.0 109.361 178.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.433 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 98.6 mm-40 54.59 -167.22 0.08 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.101 -0.999 . . . . 0.0 110.77 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.409 ' HG3' ' H ' ' A' ' 29' ' ' SER . 15.6 tp60 64.06 -168.36 0.21 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.537 -0.727 . . . . 0.0 109.274 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.683 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 58.9 m -131.84 147.15 52.46 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.365 -0.834 . . . . 0.0 109.441 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.8 p -128.37 143.11 50.96 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 1.055 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 77.7 m -67.63 148.08 51.85 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.006 -1.059 . . . . 0.0 109.874 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -147.71 149.7 32.93 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.117 -0.989 . . . . 0.0 110.275 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.79 135.51 57.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.625 -1.297 . . . . 0.0 109.26 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? . . . . . 0 N--CA 1.483 1.206 0 O-C-N 121.241 -0.912 . . . . 0.0 111.877 -177.938 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.631 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 121.171 0.51 . . . . 0.0 109.689 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.697 ' C ' ' HB1' ' A' ' 6' ' ' ALA . . . -59.51 -89.99 0.02 OUTLIER Glycine 0 N--CA 1.494 2.513 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.287 -178.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 1.3 t 87.13 -173.78 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.683 -0.893 . . . . 0.0 110.54 -178.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.524 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 71.5 tttt -43.66 126.64 4.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.569 -0.707 . . . . 0.0 109.842 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.524 ' HG2' ' HG2' ' A' ' 4' ' ' LYS . 0.4 OUTLIER 46.92 81.26 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -177.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.697 ' HB1' ' C ' ' A' ' 2' ' ' GLY . . . -178.81 126.78 0.1 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.242 -177.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.788 ' HA ' ' O ' ' A' ' 29' ' ' SER . 31.8 t90 -52.77 137.74 30.85 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.662 0.744 . . . . 0.0 111.692 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.707 ' SG ' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -122.03 170.98 9.3 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.478 178.405 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.707 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -121.98 -36.8 2.94 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.521 -1.362 . . . . 0.0 108.041 177.871 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.728 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 44.6 mt-10 -148.36 169.51 20.0 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 tptm -59.05 -23.77 62.28 Favored 'General case' 0 C--N 1.292 -1.893 0 O-C-N 121.076 -1.015 . . . . 0.0 108.72 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -93.33 -33.98 13.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.612 -0.68 . . . . 0.0 111.282 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.402 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -63.74 -6.98 6.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.006 -1.059 . . . . 0.0 110.58 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.709 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.4 t -93.96 160.77 14.58 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.497 -0.752 . . . . 0.0 108.998 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.631 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 94.1 m -56.78 140.0 49.14 Favored 'General case' 0 C--N 1.306 -1.312 0 O-C-N 120.985 -1.072 . . . . 0.0 109.108 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.43 129.31 41.24 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 104.0 -4.14 45.26 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.709 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 95.3 m-85 -117.99 141.18 48.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.942 -1.328 . . . . 0.0 109.32 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.833 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 5.3 p-10 -90.91 144.03 26.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.323 -0.86 . . . . 0.0 108.739 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.728 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 18.0 m -90.31 136.29 33.14 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.576 0.703 . . . . 0.0 111.253 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 29' ' ' SER . 41.9 t -117.25 101.48 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -73.85 114.46 12.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.338 -0.851 . . . . 0.0 109.42 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.65 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -94.93 88.81 5.4 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.279 -0.888 . . . . 0.0 110.506 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.621 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -51.86 -2.05 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.384 -0.823 . . . . 0.0 109.941 178.489 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.65 ' H ' ' C ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -60.37 -49.31 78.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.083 -1.011 . . . . 0.0 109.637 -179.047 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.541 ' ND2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -151.27 46.75 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.234 -0.916 . . . . 0.0 109.286 179.464 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 52.28 37.95 23.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.466 -0.771 . . . . 0.0 110.165 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.474 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 8.3 tt0 -120.36 114.14 21.4 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.21 -0.931 . . . . 0.0 109.513 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.788 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.7 m -95.24 172.37 8.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.948 -1.095 . . . . 0.0 109.277 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 20' ' ' CYS . 1.6 t -144.56 -157.81 0.82 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.236 -0.915 . . . . 0.0 109.849 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.833 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -165.73 138.49 4.21 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.018 -179.729 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -145.2 144.25 30.74 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.695 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 1.1 ptp85 -57.57 110.27 0.85 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.151 -0.968 . . . . 0.0 111.45 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.649 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 178.143 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.503 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 19.4 p . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.626 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -88.41 114.7 4.27 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.41 -1.376 . . . . 0.0 109.892 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 4' ' ' LYS . 3.6 m -94.31 -159.52 0.71 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.142 -1.211 . . . . 0.0 107.736 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 11.6 tmtt? -46.9 147.54 1.31 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.426 -1.421 . . . . 0.0 108.286 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.564 ' CG ' ' O ' ' A' ' 5' ' ' ARG . 8.1 ptm180 39.2 78.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.563 1.173 . . . . 0.0 109.286 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.71 125.96 0.08 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.442 -0.787 . . . . 0.0 109.266 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.665 ' HA ' ' O ' ' A' ' 29' ' ' SER . 72.5 t90 -45.06 134.1 6.19 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.578 0.704 . . . . 0.0 111.729 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -123.83 136.03 54.13 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.441 ' HB3' ' CG ' ' A' ' 13' ' ' ASP . 31.0 tttm -82.73 -40.87 19.97 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.696 ' CG ' ' H ' ' A' ' 11' ' ' LYS . 62.8 tt0 -156.55 179.58 9.12 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.696 ' H ' ' CG ' ' A' ' 10' ' ' GLU . 1.6 ttpm? -58.87 -43.96 90.96 Favored 'General case' 0 C--N 1.285 -2.214 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.874 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -69.63 -37.79 76.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.358 -0.839 . . . . 0.0 110.582 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.441 ' CG ' ' HB3' ' A' ' 9' ' ' LYS . 10.3 t70 -60.34 -23.47 64.27 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.779 -1.201 . . . . 0.0 110.577 -178.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.73 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.3 t -79.56 142.96 35.24 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.024 -1.048 . . . . 0.0 108.833 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -51.47 121.95 7.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.835 0.826 . . . . 0.0 109.429 -177.759 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' CYS . 1.3 t -38.1 137.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.274 0.559 . . . . 0.0 109.523 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.79 -14.24 58.96 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.73 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 67.7 m-85 -111.23 150.47 29.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.994 -1.298 . . . . 0.0 110.312 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.606 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.9 t30 -97.46 132.24 43.35 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.442 -0.787 . . . . 0.0 109.93 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 5.3 m -85.94 143.01 28.41 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.276 -0.89 . . . . 0.0 109.863 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -134.61 143.57 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -109.94 111.78 23.38 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 108.717 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.636 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -89.64 93.36 9.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.914 -1.116 . . . . 0.0 109.264 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -54.23 -38.14 65.4 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.403 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.611 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -60.37 -46.65 89.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.947 -1.096 . . . . 0.0 108.931 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.434 ' C ' ' H ' ' A' ' 28' ' ' GLN . 81.1 m-20 -92.45 -6.75 49.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.191 -0.943 . . . . 0.0 108.8 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.636 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER 58.72 6.48 0.62 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.432 -0.793 . . . . 0.0 109.474 -179.831 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.434 ' H ' ' C ' ' A' ' 26' ' ' ASN . 29.1 mm100 -109.99 137.19 48.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.346 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.665 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.4 m -93.82 144.5 25.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.083 -1.011 . . . . 0.0 108.427 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.6 p -142.93 127.98 18.51 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.372 -0.83 . . . . 0.0 109.776 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.606 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -69.85 160.45 31.77 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.342 -0.849 . . . . 0.0 110.545 -179.945 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -145.18 141.28 28.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.541 -0.724 . . . . 0.0 109.057 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.449 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -70.19 128.94 37.99 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.594 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 94.5 mttt . . . . . 0 C--N 1.303 -1.431 0 O-C-N 120.856 -1.152 . . . . 0.0 109.855 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.543 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 25.5 p . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.99 129.94 9.82 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 4' ' ' LYS . 29.6 m -99.28 -170.48 1.92 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -1.114 . . . . 0.0 108.541 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' A' ' 3' ' ' SER . 48.4 tttm -46.87 128.73 11.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.555 -1.341 . . . . 0.0 107.565 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 62.09 79.36 0.26 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.361 -0.935 . . . . 0.0 108.635 -178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.55 129.97 0.1 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.246 -0.908 . . . . 0.0 109.927 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.772 ' HA ' ' O ' ' A' ' 29' ' ' SER . 45.4 t90 -53.27 138.47 32.16 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.424 0.63 . . . . 0.0 111.961 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.552 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -122.2 160.68 24.68 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.505 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.475 ' N ' ' OD2' ' A' ' 13' ' ' ASP . 18.3 tttt -85.78 -45.83 11.24 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.285 -0.884 . . . . 0.0 109.202 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.612 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 93.1 mt-10 -145.19 -167.34 2.65 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.661 0.744 . . . . 0.0 109.263 -179.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.494 ' HZ2' HD21 ' A' ' 38' ' ' LEU . 16.9 tptt -62.67 -40.92 98.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.829 -0.545 . . . . 0.0 110.253 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -87.52 -3.07 59.0 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.112 -0.993 . . . . 0.0 110.761 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.612 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 24.8 t70 -80.93 -3.6 52.04 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.874 -1.141 . . . . 0.0 111.951 -177.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 34.2 m -86.09 145.08 27.2 Favored 'General case' 0 C--N 1.308 -1.233 0 O-C-N 120.298 -1.501 . . . . 0.0 108.862 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.543 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 72.5 m -51.39 161.67 0.43 Allowed 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 -179.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.51 ' HA ' ' CB ' ' A' ' 43' ' ' CYS . 1.0 OUTLIER -58.33 137.55 57.11 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.41 4.3 87.98 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -130.95 141.53 50.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -1.205 . . . . 0.0 110.414 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 31.3 p-10 -104.36 166.91 10.09 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.936 -1.102 . . . . 0.0 109.181 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.8 t -102.81 130.69 49.88 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.239 -0.913 . . . . 0.0 109.569 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.05 128.55 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -79.3 123.75 27.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.082 -1.012 . . . . 0.0 109.121 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -101.57 74.2 1.5 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.285 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.1 p-90 -54.55 -36.06 63.91 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.094 -1.004 . . . . 0.0 109.786 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.64 -26.07 55.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.0 109.361 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.557 ' ND2' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -141.73 28.85 1.75 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.947 . . . . 0.0 108.897 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 23' ' ' ALA . 5.9 mp0 48.89 -171.0 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.523 -0.736 . . . . 0.0 109.23 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.46 ' O ' ' O ' ' A' ' 27' ' ' GLN . 4.0 mm-40 57.87 153.93 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.36 -0.838 . . . . 0.0 110.196 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.772 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 40.4 m -114.69 132.76 56.3 Favored 'General case' 1 C--O 1.148 -4.243 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.328 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.7 p -107.91 127.09 53.44 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.591 0.71 . . . . 0.0 110.75 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 79.9 m -71.66 148.92 46.03 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.443 -0.786 . . . . 0.0 110.263 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.501 ' O ' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -147.02 149.56 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.73 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.616 ' O ' ' CB ' ' A' ' 34' ' ' LYS . 10.4 ptt180 -51.93 -165.24 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.055 -1.028 . . . . 0.0 111.66 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.616 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 91.7 mttt 121.4 106.6 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 123.592 0.757 . . . . 0.0 109.807 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 39.7 m0 -114.02 -74.04 0.64 Allowed 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 123.224 1.488 . . . . 0.0 108.593 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -63.03 -31.2 72.29 Favored 'General case' 0 C--N 1.29 -2.014 0 O-C-N 120.806 -1.184 . . . . 0.0 109.722 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -77.44 12.74 1.44 Allowed 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.399 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.494 HD21 ' HZ2' ' A' ' 11' ' ' LYS . 4.1 tp -131.04 145.94 52.2 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 120.994 -1.066 . . . . 0.0 109.884 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.503 ' O ' ' N ' ' A' ' 41' ' ' GLY . 3.2 m-85 -57.33 142.85 42.01 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.467 -0.77 . . . . 0.0 109.748 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.428 ' C ' ' O ' ' A' ' 39' ' ' PHE . 75.9 p 42.62 -95.47 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.459 -0.776 . . . . 0.0 109.909 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 42' ' ' GLU . . . 123.32 -133.68 9.09 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 108.908 -1.677 . . . . 0.0 108.908 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.556 ' O ' ' O ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER 54.42 112.11 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.357 -1.084 . . . . 0.0 108.584 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.51 ' CB ' ' HA ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.105 -0.997 . . . . 0.0 110.252 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.506 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 28.8 p . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.637 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -73.29 118.45 6.27 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 108.19 -1.964 . . . . 0.0 108.19 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.7 m -99.02 -161.21 0.86 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.306 . . . . 0.0 109.056 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -53.14 125.06 16.18 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 56.46 86.82 0.06 Allowed 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 178.52 135.25 0.08 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.771 0.796 . . . . 0.0 109.955 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.678 ' HA ' ' O ' ' A' ' 29' ' ' SER . 40.7 t90 -50.54 143.57 9.06 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.603 0.716 . . . . 0.0 111.061 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.63 148.37 46.51 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -95.24 -32.04 13.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.918 -1.114 . . . . 0.0 109.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.436 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 78.4 mm-40 -154.65 177.92 10.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.354 -0.841 . . . . 0.0 108.885 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -60.35 -48.86 79.94 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.466 ' C ' ' H ' ' A' ' 14' ' ' CYS . 16.4 ttmm -76.47 -35.03 58.66 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.741 -0.6 . . . . 0.0 111.128 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.436 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 7.8 m-20 -59.87 -1.3 0.27 Allowed 'General case' 0 N--CA 1.482 1.14 0 O-C-N 121.004 -1.06 . . . . 0.0 110.618 -178.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.655 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 47.9 t -90.58 147.68 23.18 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.021 -1.049 . . . . 0.0 108.753 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.506 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -58.1 139.83 53.94 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.217 -0.927 . . . . 0.0 109.677 -179.328 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 126.22 21.41 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.831 -0.747 . . . . 0.0 109.024 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.62 -6.78 24.33 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.655 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 86.0 m-85 -128.69 143.75 51.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.307 -1.114 . . . . 0.0 110.792 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.53 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 65.5 t30 -102.9 145.84 29.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.494 -0.754 . . . . 0.0 109.123 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.4 t -86.95 128.92 35.06 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.031 -1.043 . . . . 0.0 109.143 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 88.3 t -128.6 136.38 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.568 -0.707 . . . . 0.0 110.061 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -66.63 140.41 57.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.409 -0.807 . . . . 0.0 109.305 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.784 ' HB3' HD22 ' A' ' 26' ' ' ASN . . . -87.2 -142.58 0.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.519 -0.738 . . . . 0.0 110.27 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.518 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 8.9 p90 -172.22 -42.15 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.991 -0.683 . . . . 0.0 111.188 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.518 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -100.01 11.03 40.3 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.41 -1.432 . . . . 0.0 110.078 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 1.037 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -140.42 2.41 1.85 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.448 -0.783 . . . . 0.0 109.127 178.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.3 mm-40 46.79 34.21 2.49 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.089 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -122.57 -167.79 1.63 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.51 -0.744 . . . . 0.0 109.276 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.678 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.2 m -127.86 123.41 35.02 Favored 'General case' 0 C--O 1.181 -2.54 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 p -112.8 120.01 39.99 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.194 -0.941 . . . . 0.0 110.143 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -67.39 143.61 56.22 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.716 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -148.02 134.56 19.77 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.62 ' O ' ' CD1' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -62.6 110.8 1.82 Allowed 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.15 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -68.94 -13.31 62.37 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 120.973 -1.08 . . . . 0.0 111.286 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.746 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 36.4 m95 57.43 -162.05 0.21 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.996 -1.065 . . . . 0.0 109.441 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.746 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 98.7 mttt 90.73 -1.98 0.23 Allowed 'General case' 0 N--CA 1.495 1.822 0 CA-C-O 120.982 0.42 . . . . 0.0 109.954 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.604 ' OH ' ' HD3' ' A' ' 33' ' ' ARG . 30.8 p90 -131.88 79.47 1.87 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.774 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.694 ' O ' ' C ' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -64.94 157.18 28.79 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.694 ' C ' ' O ' ' A' ' 38' ' ' LEU . 0.4 OUTLIER 13.77 78.57 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 121.852 0.834 . . . . 0.0 109.87 -178.477 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.5 m -163.36 145.15 9.69 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.22 146.22 43.46 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.492 ' CD ' ' CZ ' ' A' ' 37' ' ' TYR . 1.9 tt0 -142.59 156.94 45.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.405 -1.056 . . . . 0.0 109.513 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.402 ' OXT' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 117.944 -1.027 . . . . 0.0 109.276 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.488 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 26.2 p . . . . . 0 N--CA 1.489 1.485 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.51 138.39 28.83 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 108.694 -1.762 . . . . 0.0 108.694 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.541 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 26.1 t -100.7 -138.63 0.33 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.281 -1.129 . . . . 0.0 108.701 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.541 ' N ' ' OG ' ' A' ' 3' ' ' SER . 12.7 tmtt? -61.39 128.43 36.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.675 -1.265 . . . . 0.0 107.745 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.682 ' N ' ' O ' ' A' ' 31' ' ' CYS . 45.0 ptt85 41.76 90.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 122.578 1.18 . . . . 0.0 108.92 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -169.59 139.15 2.0 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-O 122.039 0.923 . . . . 0.0 109.377 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.634 ' HA ' ' O ' ' A' ' 29' ' ' SER . 0.6 OUTLIER -47.07 131.63 12.42 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.713 0.768 . . . . 0.0 112.217 -177.603 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.587 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -121.09 152.32 38.82 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 177.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.61 ' HZ2' ' HE1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -98.6 -28.37 13.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.897 -1.127 . . . . 0.0 109.058 178.618 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.603 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 24.5 mt-10 -145.33 179.2 7.55 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-O 121.761 0.791 . . . . 0.0 109.825 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -61.26 -47.61 85.23 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.443 -0.786 . . . . 0.0 109.003 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 14' ' ' CYS . 85.1 tttt -83.56 -22.35 32.38 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.397 -0.815 . . . . 0.0 109.898 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.603 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 14.7 t70 -47.33 -11.88 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.019 -1.05 . . . . 0.0 109.882 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.547 ' N ' ' O ' ' A' ' 12' ' ' LYS . 59.9 m -83.25 133.57 34.99 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.475 ' C ' ' O ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -42.07 145.99 0.32 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.358 -0.839 . . . . 0.0 109.378 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -49.67 125.42 11.51 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.557 -0.714 . . . . 0.0 109.209 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.01 0.25 41.6 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -129.84 141.95 50.75 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.609 -0.936 . . . . 0.0 109.501 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.699 ' ND2' ' O ' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -103.56 158.89 16.05 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.212 -0.93 . . . . 0.0 109.24 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 39.1 t -92.37 112.67 24.7 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.763 -1.211 . . . . 0.0 110.031 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.49 ' O ' ' CB ' ' A' ' 29' ' ' SER . 75.5 t -89.28 132.07 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -81.02 124.53 29.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.245 -0.91 . . . . 0.0 109.292 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -114.03 118.63 34.64 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.949 0.88 . . . . 0.0 110.55 -179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.584 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -54.29 -11.95 0.58 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.521 ' CD1' ' O ' ' A' ' 25' ' ' TYR . 34.7 p90 -94.75 129.92 41.49 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.371 -1.456 . . . . 0.0 110.102 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.604 ' O ' ' C ' ' A' ' 27' ' ' GLN . 68.1 m-20 55.14 34.16 22.02 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.478 -0.764 . . . . 0.0 109.446 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.604 ' C ' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 29.44 43.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 122.261 1.029 . . . . 0.0 108.592 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.579 ' OE1' ' N ' ' A' ' 29' ' ' SER . 1.2 tm0? -111.36 163.62 13.79 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.634 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 14.6 m -125.8 148.33 49.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.185 -0.947 . . . . 0.0 110.473 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -108.44 117.21 33.57 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.63 -0.669 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.682 ' O ' ' N ' ' A' ' 5' ' ' ARG . 96.6 m -65.74 130.55 43.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.955 -1.091 . . . . 0.0 109.131 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.699 ' O ' ' ND2' ' A' ' 19' ' ' ASN . 95.5 mt-10 -146.98 135.09 21.54 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.966 -1.084 . . . . 0.0 110.639 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -74.92 107.45 7.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.402 -0.811 . . . . 0.0 110.183 178.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.03 41.92 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.563 -1.336 . . . . 0.0 111.461 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.573 ' O ' ' N ' ' A' ' 37' ' ' TYR . 5.1 m95 -120.54 -165.28 1.18 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.024 -1.047 . . . . 0.0 108.844 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -62.67 67.73 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.319 -0.863 . . . . 0.0 109.535 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.573 ' N ' ' O ' ' A' ' 35' ' ' TRP . 3.8 m-85 -115.77 44.51 1.89 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.274 -0.891 . . . . 0.0 109.254 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 48.4 tp -62.74 -42.28 99.59 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.083 -1.011 . . . . 0.0 108.4 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.2 t80 178.08 62.4 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -80.7 -4.87 55.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.265 -0.897 . . . . 0.0 110.253 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.585 ' O ' ' HG2' ' A' ' 42' ' ' GLU . . . 65.2 95.56 0.02 OUTLIER Glycine 0 N--CA 1.49 2.249 0 N-CA-C 108.616 -1.794 . . . . 0.0 108.616 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.683 ' O ' ' C ' ' A' ' 43' ' ' CYS . 3.5 pt-20 54.49 116.56 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.677 -0.896 . . . . 0.0 109.356 -179.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.683 ' C ' ' O ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.702 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.547 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.4 p . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.01 141.15 35.53 Favored Glycine 0 N--CA 1.487 2.098 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.6 m -108.09 -152.96 0.49 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.378 -1.072 . . . . 0.0 109.207 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.07 118.83 4.35 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.098 -1.001 . . . . 0.0 108.588 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.519 ' HE ' ' CA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 53.96 91.55 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 122.087 0.946 . . . . 0.0 108.555 -178.798 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -175.77 125.7 0.22 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.844 0.83 . . . . 0.0 109.092 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.633 ' HA ' ' O ' ' A' ' 29' ' ' SER . 1.9 t90 -40.15 138.31 0.87 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.611 0.719 . . . . 0.0 110.856 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.724 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -111.57 140.28 46.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.6 tttm -86.71 -37.68 17.7 Favored 'General case' 0 C--N 1.294 -1.814 0 O-C-N 121.415 -0.803 . . . . 0.0 109.09 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.64 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 28.2 mt-10 -151.26 162.77 40.3 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.546 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -57.55 -32.64 67.31 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.104 -0.997 . . . . 0.0 108.611 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.5 -4.63 58.99 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.065 -1.022 . . . . 0.0 109.57 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.433 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -92.64 5.15 52.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.811 -1.181 . . . . 0.0 111.651 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.724 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 16.5 m -88.39 140.2 29.71 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.268 -1.52 . . . . 0.0 107.665 178.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 73.6 m -51.11 146.81 5.96 Favored 'General case' 0 N--CA 1.502 2.132 0 C-N-CA 117.078 -1.849 . . . . 0.0 110.407 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -52.01 118.63 3.59 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 121.195 -0.94 . . . . 0.0 110.259 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.05 -14.45 11.16 Favored Glycine 1 N--CA 1.534 5.167 0 C-N-CA 119.214 -1.47 . . . . 0.0 109.748 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -125.86 144.69 50.56 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.33 -1.1 . . . . 0.0 109.156 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.597 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 p-10 -108.64 175.73 5.36 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.039 -1.038 . . . . 0.0 109.404 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.64 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 1.6 m -90.5 135.84 33.44 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.851 -1.156 . . . . 0.0 110.472 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.63 100.56 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.453 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 24.3 t80 -67.32 126.14 28.32 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.12 -178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.15 100.83 13.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.275 -0.89 . . . . 0.0 108.931 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.486 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -50.17 -27.65 6.19 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 108.869 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.48 ' C ' ' H ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -99.41 149.5 23.12 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.496 ' OD1' ' O ' ' A' ' 26' ' ' ASN . 1.1 p30 51.29 12.47 0.14 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.968 -1.082 . . . . 0.0 108.852 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.48 ' H ' ' C ' ' A' ' 25' ' ' TYR . 97.1 mm-40 43.94 -148.81 0.06 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.512 -0.742 . . . . 0.0 109.119 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 27' ' ' GLN . 98.6 mt-30 60.39 134.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.264 -0.897 . . . . 0.0 110.214 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.633 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 34.2 m -96.89 170.47 9.14 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.456 -0.778 . . . . 0.0 109.537 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -141.21 129.69 22.56 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.321 -0.862 . . . . 0.0 109.431 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.597 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 96.5 m -72.27 131.27 42.47 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.615 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.409 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 1.0 OUTLIER -150.05 128.41 12.14 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.152 -0.968 . . . . 0.0 109.979 179.471 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.499 ' C ' ' CD ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.69 146.57 54.55 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.445 -0.784 . . . . 0.0 109.647 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.555 ' HZ2' ' ND2' ' A' ' 19' ' ' ASN . 42.1 mttt -126.14 -99.32 0.39 Allowed 'General case' 0 N--CA 1.485 1.278 0 O-C-N 121.248 -0.908 . . . . 0.0 110.48 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -118.5 158.73 24.81 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.825 0.821 . . . . 0.0 109.884 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.1 tttp -66.53 -10.04 40.98 Favored 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.713 -0.617 . . . . 0.0 110.635 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.566 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -67.45 -8.56 34.28 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 120.912 -1.117 . . . . 0.0 108.698 -179.02 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.602 ' O ' ' O ' ' A' ' 39' ' ' PHE . 23.4 tp -62.41 -35.26 78.67 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.61 ' O ' ' CB ' ' A' ' 40' ' ' THR . 0.1 OUTLIER -50.93 -164.04 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 178.617 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.61 ' CB ' ' O ' ' A' ' 39' ' ' PHE . 2.5 m 87.14 25.99 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.102 -0.999 . . . . 0.0 109.676 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.68 -0.89 42.27 Favored Glycine 0 N--CA 1.496 2.652 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.498 ' OE1' ' N ' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -127.05 120.15 28.3 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.154 -1.204 . . . . 0.0 109.667 179.734 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.498 ' N ' ' OE1' ' A' ' 42' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.303 -1.434 0 CA-C-O 117.974 -1.012 . . . . 0.0 108.711 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.582 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.6 p . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 7' ' ' TRP . . . -63.02 120.12 20.01 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.563 ' HG ' ' N ' ' A' ' 4' ' ' LYS . 10.9 t -96.69 -163.49 1.05 Allowed 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.181 -1.188 . . . . 0.0 108.744 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.563 ' N ' ' HG ' ' A' ' 3' ' ' SER . 15.7 tttp -45.47 121.59 3.09 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.187 -0.946 . . . . 0.0 108.604 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 56.66 86.89 0.06 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.15 152.43 1.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.337 -0.852 . . . . 0.0 110.865 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 8' ' ' CYS . 20.2 t90 -53.7 154.19 3.95 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.905 0.859 . . . . 0.0 112.213 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.629 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -132.11 136.01 46.83 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -87.95 -46.94 8.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.589 -1.319 . . . . 0.0 107.547 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.783 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 95.7 mt-10 -141.38 178.41 7.45 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.462 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.1 tttt -58.38 -45.98 87.25 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.516 -0.874 . . . . 0.0 109.432 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' NZ ' ' CB ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.04 -34.33 71.17 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.198 -0.939 . . . . 0.0 110.44 179.351 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.549 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 3.4 t70 -52.91 -6.76 0.06 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.292 -0.88 . . . . 0.0 112.045 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.711 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 12.7 m -86.47 146.46 26.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 120.404 -1.435 . . . . 0.0 108.904 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.582 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 71.0 m -52.87 137.05 33.07 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -46.03 122.97 4.19 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.396 -0.815 . . . . 0.0 109.753 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.61 -8.07 24.15 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -125.52 142.52 51.46 Favored 'General case' 0 C--O 1.286 2.989 0 O-C-N 121.092 -1.24 . . . . 0.0 111.829 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.495 ' ND2' ' N ' ' A' ' 20' ' ' CYS . 2.8 t30 -100.12 163.2 12.52 Favored 'General case' 0 N--CA 1.499 2.007 1 O-C-N 116.067 -4.145 . . . . 0.0 108.952 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.783 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 24.8 m -90.19 130.71 36.3 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 120.488 -1.382 . . . . 0.0 109.849 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -133.84 159.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.589 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.512 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 57.2 t80 -102.99 127.47 50.21 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.187 -0.946 . . . . 0.0 110.137 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.611 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -93.49 113.0 25.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.161 -0.962 . . . . 0.0 109.257 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.1 p-90 -53.89 1.73 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.323 -0.861 . . . . 0.0 110.74 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.611 ' H ' ' C ' ' A' ' 23' ' ' ALA . 36.2 p90 -123.91 148.24 47.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.991 -1.068 . . . . 0.0 109.224 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 54.51 17.22 1.55 Allowed 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.516 ' C ' ' O ' ' A' ' 26' ' ' ASN . 53.7 mm-40 24.94 65.08 0.05 Allowed 'General case' 0 N--CA 1.5 2.048 0 CA-C-O 121.12 0.486 . . . . 0.0 111.459 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.522 ' HB3' HD22 ' A' ' 26' ' ' ASN . 41.8 tt0 -132.42 155.68 48.06 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.232 -0.917 . . . . 0.0 109.742 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.612 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.4 m -90.17 118.64 29.85 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.3 t -103.98 124.24 48.65 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 120.963 -1.086 . . . . 0.0 111.184 -178.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 88.4 m -67.48 119.24 11.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.134 -0.978 . . . . 0.0 109.316 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.474 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 1.9 pt-20 -144.5 121.31 11.25 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.491 HH22 ' CD2' ' A' ' 38' ' ' LEU . 4.3 tpt180 -70.93 167.05 19.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.683 -1.261 . . . . 0.0 110.194 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.662 ' C ' ' CG ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -127.33 40.67 3.66 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.325 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.682 ' O ' ' C ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 59.13 -87.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.071 -1.018 . . . . 0.0 108.942 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.682 ' C ' ' O ' ' A' ' 35' ' ' TRP . 37.6 mttt 7.91 78.38 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.211 0.529 . . . . 0.0 110.43 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -55.01 79.22 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.878 0.847 . . . . 0.0 109.843 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.695 ' HG ' ' N ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -57.1 -174.4 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 179.562 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.695 ' N ' ' HG ' ' A' ' 38' ' ' LEU . 50.5 t80 -166.68 97.42 0.56 Allowed 'General case' 0 C--N 1.306 -1.325 0 O-C-N 120.96 -1.087 . . . . 0.0 109.698 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.5 p -159.64 113.76 2.3 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 67.74 -135.87 30.98 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 107.819 -2.112 . . . . 0.0 107.819 -178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -144.8 97.01 2.96 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.904 -1.35 . . . . 0.0 109.826 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.307 -1.254 0 O-C-N 121.043 -1.036 . . . . 0.0 108.991 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.503 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -81.03 132.69 11.4 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.475 ' O ' ' C ' ' A' ' 4' ' ' LYS . 21.7 m -104.45 -162.45 0.89 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.357 -1.084 . . . . 0.0 108.675 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.475 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.9 OUTLIER -44.25 130.93 6.3 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.649 -1.282 . . . . 0.0 108.096 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 mtp85 54.37 82.51 0.09 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.989 -1.069 . . . . 0.0 108.713 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 125.62 0.24 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.996 -1.065 . . . . 0.0 110.514 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.51 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.1 t90 -49.07 131.32 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.419 0.628 . . . . 0.0 111.078 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.525 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -117.87 153.17 33.99 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 178.26 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.656 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 6.8 tmtt? -94.77 -25.19 16.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.03 . . . . 0.0 108.718 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.525 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 5.9 pt-20 -165.65 -171.82 2.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.408 -0.807 . . . . 0.0 109.277 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.42 -45.25 94.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.301 -0.874 . . . . 0.0 109.229 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.9 tptp -70.39 -25.26 63.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.327 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.656 ' CG ' ' H ' ' A' ' 9' ' ' LYS . 11.5 t70 -63.75 -17.62 63.22 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.274 -0.891 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.1 m -83.57 122.17 28.2 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 119.943 -1.723 . . . . 0.0 107.961 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.537 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.99 -173.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 122.132 0.967 . . . . 0.0 111.418 -177.81 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.537 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.5 OUTLIER 22.08 -143.23 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.722 177.281 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.598 ' H ' ' CB ' ' A' ' 43' ' ' CYS . . . -89.45 29.94 5.92 Favored Glycine 0 C--N 1.284 -2.348 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.597 ' CD1' ' HB2' ' A' ' 33' ' ' ARG . 91.4 m-85 -82.83 135.41 34.96 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.534 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 17.3 p-10 -99.07 149.0 23.46 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.951 -1.093 . . . . 0.0 109.391 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.445 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 15.2 t -90.89 126.27 36.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.148 -0.97 . . . . 0.0 110.152 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 66.7 t -120.25 130.95 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.487 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 14.5 t80 -78.12 122.41 25.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.906 -1.121 . . . . 0.0 109.025 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.59 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -98.38 88.66 4.2 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -7.67 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.099 -1.001 . . . . 0.0 109.469 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.59 ' H ' ' C ' ' A' ' 23' ' ' ALA . 3.4 m-85 -58.47 -46.69 86.1 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.082 -1.011 . . . . 0.0 109.864 -179.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.617 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -147.98 45.63 1.08 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.05 -1.031 . . . . 0.0 109.797 -179.597 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.487 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 96.6 mm-40 44.12 42.84 5.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.225 -0.922 . . . . 0.0 109.025 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -120.93 138.42 54.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.737 -0.602 . . . . 0.0 109.691 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.51 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 0.7 OUTLIER -95.62 112.95 24.56 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.293 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.0 t -98.52 114.98 27.59 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.042 -1.036 . . . . 0.0 110.831 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.0 m -67.89 145.22 54.8 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.262 -0.898 . . . . 0.0 109.183 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.534 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 97.8 mt-10 -146.46 107.45 4.16 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.987 -1.071 . . . . 0.0 112.077 -178.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.627 ' HD2' ' H ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -79.14 131.84 36.35 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.613 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt -111.65 19.47 18.05 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.699 -1.25 . . . . 0.0 108.44 178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.77 ' C ' ' H ' ' A' ' 37' ' ' TYR . 32.0 m95 -117.65 -3.3 11.31 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -56.47 27.16 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.655 -0.653 . . . . 0.0 110.686 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.77 ' H ' ' C ' ' A' ' 35' ' ' TRP . 85.6 m-85 -101.58 104.38 15.25 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.896 ' O ' ' HB2' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 70.08 163.6 0.25 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.204 -0.935 . . . . 0.0 108.631 -178.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.896 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 0.2 OUTLIER 102.26 176.22 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.611 ' C ' ' H ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -74.75 175.87 7.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.224 -0.922 . . . . 0.0 109.725 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.471 ' N ' ' OG1' ' A' ' 40' ' ' THR . . . -58.43 2.11 0.22 Allowed Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.611 ' H ' ' C ' ' A' ' 40' ' ' THR . 80.5 tt0 -94.86 133.89 38.09 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.262 -1.14 . . . . 0.0 108.79 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.598 ' CB ' ' H ' ' A' ' 17' ' ' GLY . 1.2 p . . . . . 0 N--CA 1.496 1.857 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.594 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.756 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 11.0 p . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.068 0.461 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.565 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -66.14 -51.07 47.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.542 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 2.6 t 86.33 -169.2 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.471 0.653 . . . . 0.0 110.298 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.402 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 24.4 tttm -52.36 128.63 26.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.345 -0.847 . . . . 0.0 109.366 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttm-85 49.18 84.2 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.12 139.53 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.809 -0.757 . . . . 0.0 110.46 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.862 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.3 t90 -43.69 127.02 4.84 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.511 0.672 . . . . 0.0 110.878 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 29' ' ' SER . 22.0 p -123.98 133.61 53.65 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -91.82 -44.73 8.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.405 -1.434 . . . . 0.0 109.139 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -149.72 178.45 8.86 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -61.03 -47.61 85.64 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.59 -0.694 . . . . 0.0 109.989 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.625 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.26 -38.16 78.27 Favored 'General case' 0 C--N 1.292 -1.926 0 O-C-N 120.307 -1.495 . . . . 0.0 112.564 178.764 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 97.2 m-20 -66.98 -10.83 53.78 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.144 -0.972 . . . . 0.0 109.888 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.487 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 22.9 t -91.97 150.95 20.73 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.825 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.756 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.7 OUTLIER -61.89 135.88 57.75 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.38 143.25 6.68 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.761 -1.212 . . . . 0.0 109.039 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.19 -3.64 69.85 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.487 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 48.2 m-85 -125.92 141.28 52.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.297 -1.12 . . . . 0.0 111.284 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.531 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 12.5 p-10 -98.42 144.12 28.13 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 t -88.43 136.31 33.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.555 -0.716 . . . . 0.0 109.691 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.426 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 72.4 t -123.13 131.27 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -102.8 122.64 44.91 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.114 -0.991 . . . . 0.0 108.351 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.34 115.3 26.7 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.752 -1.218 . . . . 0.0 109.498 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.406 ' CD1' ' CD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -50.49 -27.19 6.12 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.623 -0.673 . . . . 0.0 110.06 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.956 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.1 p90 -99.23 164.5 12.11 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.003 -1.061 . . . . 0.0 110.175 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.956 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 45.78 13.6 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 CA-C-O 121.143 0.497 . . . . 0.0 110.339 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 25' ' ' TYR . 95.3 mm-40 34.0 46.3 0.14 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.616 -0.677 . . . . 0.0 111.04 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.633 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 tp60 -120.23 127.07 52.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.256 -0.903 . . . . 0.0 109.29 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.862 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.5 m -101.42 150.86 22.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 27.7 t -149.32 129.43 13.58 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.626 -1.296 . . . . 0.0 111.091 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.5 OUTLIER -73.22 159.95 32.67 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.289 -0.882 . . . . 0.0 111.453 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -146.09 159.03 43.85 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.323 -0.86 . . . . 0.0 110.142 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.564 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -60.76 132.48 54.02 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.699 0.761 . . . . 0.0 111.878 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 5.8 mmmt -150.69 39.68 0.72 Allowed 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.548 ' CD1' ' N ' ' A' ' 35' ' ' TRP . 18.9 m0 64.14 -162.58 0.27 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.7 -0.625 . . . . 0.0 110.122 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.18 23.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.71 -1.244 . . . . 0.0 111.182 -178.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.52 -7.43 4.15 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.894 -1.129 . . . . 0.0 109.979 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' A' ' 39' ' ' PHE . 1.4 mm? -63.25 -44.83 94.05 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.259 -0.901 . . . . 0.0 111.357 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.501 ' O ' ' O ' ' A' ' 38' ' ' LEU . 27.3 m-85 -60.55 -117.6 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.579 -1.325 . . . . 0.0 108.775 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.474 ' O ' ' O ' ' A' ' 41' ' ' GLY . 33.3 p -158.58 139.67 13.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.182 -0.949 . . . . 0.0 108.77 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.474 ' O ' ' O ' ' A' ' 40' ' ' THR . . . 44.65 93.98 0.01 OUTLIER Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 63.07 159.73 0.08 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.029 -1.277 . . . . 0.0 108.466 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.017 -1.052 . . . . 0.0 109.31 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 120.919 0.39 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.614 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -52.98 122.6 21.23 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 108.926 -1.67 . . . . 0.0 108.926 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 14.7 t -102.23 -166.36 1.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -1.119 . . . . 0.0 109.466 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.498 ' N ' ' OG ' ' A' ' 3' ' ' SER . 0.5 OUTLIER -39.86 116.52 0.65 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.956 -1.09 . . . . 0.0 109.243 -179.406 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 59.97 86.32 0.1 Allowed 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.656 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.61 137.18 0.2 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.104 -0.997 . . . . 0.0 110.436 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.727 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.4 t90 -45.97 136.44 6.54 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.479 0.657 . . . . 0.0 111.94 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.97 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 2.4 p -134.11 152.29 51.77 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.655 -0.653 . . . . 0.0 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.7 mtmt -93.03 -49.26 6.1 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.769 -1.207 . . . . 0.0 108.289 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.572 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 34.2 mp0 -138.27 178.7 6.93 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.564 ' NZ ' ' OD1' ' A' ' 19' ' ' ASN . 0.7 OUTLIER -60.9 -43.58 98.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.793 -1.192 . . . . 0.0 108.187 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -65.89 -23.09 66.57 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.673 -0.642 . . . . 0.0 109.556 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.572 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 35.0 t70 -67.59 -16.09 63.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.157 -0.965 . . . . 0.0 110.701 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 83.5 m -84.81 127.33 34.08 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 120.789 -1.194 . . . . 0.0 108.128 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.568 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -57.69 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.774 0.797 . . . . 0.0 110.906 -178.452 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 13.0 t 19.6 -139.73 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 122.411 1.1 . . . . 0.0 111.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.532 ' N ' ' SG ' ' A' ' 16' ' ' CYS . . . -97.66 33.34 5.95 Favored Glycine 0 C--N 1.287 -2.177 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.444 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 78.3 m-85 -89.61 142.77 27.37 Favored 'General case' 0 C--N 1.288 -2.077 0 O-C-N 121.792 -0.828 . . . . 0.0 109.67 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.564 ' OD1' ' NZ ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -101.49 153.64 19.53 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.394 -0.816 . . . . 0.0 110.446 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.0 t -89.8 139.07 30.94 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.242 -0.911 . . . . 0.0 109.153 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -128.61 163.99 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.417 -0.802 . . . . 0.0 109.064 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.522 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 74.9 t80 -113.85 132.15 56.0 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.274 -0.891 . . . . 0.0 110.544 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -109.55 132.64 53.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.74 . . . . 0.0 110.02 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.424 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -56.9 -46.34 82.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.6 -0.688 . . . . 0.0 111.407 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.424 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -72.92 140.58 47.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.726 -1.233 . . . . 0.0 110.329 -178.226 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.658 ' O ' ' C ' ' A' ' 27' ' ' GLN . 18.9 m120 56.82 25.41 10.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.759 -0.588 . . . . 0.0 110.235 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.658 ' C ' ' O ' ' A' ' 26' ' ' ASN . 50.6 mm-40 21.78 49.25 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.607 ' N ' ' O ' ' A' ' 26' ' ' ASN . 8.8 tt0 -115.57 141.68 47.74 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.393 -0.817 . . . . 0.0 110.248 -178.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.727 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.0 m -92.7 142.85 26.9 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -129.58 133.22 47.06 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.267 -0.896 . . . . 0.0 110.858 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.97 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 99.2 m -70.77 144.07 50.99 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.43 -0.794 . . . . 0.0 110.808 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -151.31 135.52 16.76 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 4.2 tmm_? -58.77 143.55 46.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.22 -0.925 . . . . 0.0 110.285 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.505 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.7 OUTLIER -175.94 -83.51 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 O-C-N 121.511 -0.743 . . . . 0.0 110.025 178.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -113.64 -165.19 0.98 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 122.167 0.984 . . . . 0.0 109.933 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.601 ' O ' ' CG ' ' A' ' 37' ' ' TYR . 33.3 tttt -173.33 -55.69 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.711 ' O ' ' CB ' ' A' ' 38' ' ' LEU . 4.7 m-85 176.22 -24.78 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.797 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.711 ' CB ' ' O ' ' A' ' 37' ' ' TYR . 45.3 tp 123.69 173.78 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.662 ' O ' ' O ' ' A' ' 38' ' ' LEU . 0.4 OUTLIER 30.87 107.19 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.129 -0.982 . . . . 0.0 110.669 -179.623 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.468 ' C ' ' H ' ' A' ' 42' ' ' GLU . 4.2 m 78.37 10.44 1.92 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.633 -0.667 . . . . 0.0 109.298 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -75.64 22.06 1.85 Allowed Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.902 -1.279 . . . . 0.0 109.902 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.468 ' H ' ' C ' ' A' ' 40' ' ' THR . 50.6 tp10 -106.74 138.6 42.6 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.286 -1.126 . . . . 0.0 109.57 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.8 t . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 117.904 -1.045 . . . . 0.0 109.343 179.509 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.725 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.394 0.616 . . . . 0.0 109.969 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.2 150.77 51.99 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 108.336 -1.906 . . . . 0.0 108.336 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . 8.1 t -95.41 -178.07 4.31 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.136 -1.214 . . . . 0.0 108.921 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.711 ' NZ ' HH21 ' A' ' 33' ' ' ARG . 31.7 tttp -47.76 120.84 3.62 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.512 ' HE ' HH22 ' A' ' 33' ' ' ARG . 9.5 mmt85 58.77 86.21 0.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 30' ' ' SER . . . -177.5 147.1 0.49 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.281 -0.887 . . . . 0.0 110.757 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.894 ' HA ' ' O ' ' A' ' 29' ' ' SER . 58.9 t90 -39.2 135.4 0.99 Allowed 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.944 0.878 . . . . 0.0 112.165 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.924 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 17.9 p -132.02 157.98 42.71 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.26 -42.54 8.49 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.727 -1.233 . . . . 0.0 108.896 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.48 ' CG ' ' OD2' ' A' ' 13' ' ' ASP . 2.5 pt-20 -158.21 -170.23 3.05 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -61.52 -43.31 99.09 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.604 -0.685 . . . . 0.0 111.602 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -85.84 -19.43 30.65 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.683 -1.261 . . . . 0.0 112.09 -177.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.716 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 1.1 m-20 -73.15 -0.53 14.42 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 120.507 -1.371 . . . . 0.0 110.793 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 20.6 m -90.58 144.29 25.91 Favored 'General case' 0 C--N 1.308 -1.205 0 O-C-N 120.492 -1.38 . . . . 0.0 109.221 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.564 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.06 125.1 19.06 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.382 -0.823 . . . . 0.0 109.494 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.564 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -28.15 130.3 0.06 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.257 0.551 . . . . 0.0 109.975 -179.672 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.495 ' N ' ' OE2' ' A' ' 42' ' ' GLU . . . 103.02 -13.54 55.96 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.421 ' N ' ' OE2' ' A' ' 42' ' ' GLU . 46.2 m-85 -125.85 146.89 49.62 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.09 -1.241 . . . . 0.0 110.68 -179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.735 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 3.4 t30 -97.57 -166.86 1.44 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.8 t -138.12 130.54 29.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.424 -0.797 . . . . 0.0 109.044 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.3 t -139.38 154.95 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.367 -0.833 . . . . 0.0 110.137 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -75.39 126.36 30.86 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.516 -0.74 . . . . 0.0 109.618 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.08 109.68 21.77 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.286 -0.884 . . . . 0.0 110.574 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.468 ' C ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p90 -57.39 -9.5 1.07 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.285 -0.884 . . . . 0.0 111.238 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.438 ' HB3' ' ND2' ' A' ' 26' ' ' ASN . 15.4 t80 -59.78 -47.97 83.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.744 -1.223 . . . . 0.0 110.231 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.57 ' N ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -146.46 51.86 1.12 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.548 -1.345 . . . . 0.0 109.168 178.324 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 26' ' ' ASN . 26.5 mm-40 40.94 31.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.543 -0.723 . . . . 0.0 109.329 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.16 149.75 41.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.894 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.1 m -89.03 160.19 17.21 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.173 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 8.6 t -139.25 134.76 33.1 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.961 -1.087 . . . . 0.0 110.659 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.924 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 94.6 m -70.4 133.94 47.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.163 -0.961 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -150.22 144.45 25.63 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.807 -1.183 . . . . 0.0 110.353 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.711 HH21 ' NZ ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -56.52 163.21 1.85 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.483 -0.761 . . . . 0.0 110.444 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.595 ' O ' ' N ' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -157.59 57.69 0.49 Allowed 'General case' 0 C--N 1.308 -1.238 0 O-C-N 120.796 -1.19 . . . . 0.0 110.594 179.234 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.655 ' CD1' ' N ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER 58.51 -76.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.983 -1.073 . . . . 0.0 110.336 178.237 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.868 ' HZ1' ' HG1' ' A' ' 40' ' ' THR . 1.4 mptp? 84.45 29.08 0.07 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.14 0.495 . . . . 0.0 110.441 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -108.13 54.92 0.65 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.248 -0.907 . . . . 0.0 108.654 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.518 HD11 ' H ' ' A' ' 40' ' ' THR . 0.2 OUTLIER -170.14 -150.52 0.08 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.469 -0.77 . . . . 0.0 108.947 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.466 ' O ' ' C ' ' A' ' 40' ' ' THR . 0.5 OUTLIER -57.6 -27.41 62.71 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.604 -1.31 . . . . 0.0 110.489 -179.643 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.868 ' HG1' ' HZ1' ' A' ' 36' ' ' LYS . 1.4 t 34.91 -112.93 0.07 Allowed 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.285 0.564 . . . . 0.0 110.298 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.496 ' N ' ' OG1' ' A' ' 40' ' ' THR . . . 117.73 -20.35 10.96 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.495 ' OE2' ' N ' ' A' ' 17' ' ' GLY . 8.3 tm-20 -101.59 95.46 6.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.525 -0.985 . . . . 0.0 108.911 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.468 ' C ' ' O ' ' A' ' 42' ' ' GLU . 42.4 t . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.835 -1.078 . . . . 0.0 110.014 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.3 p . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.521 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -75.65 131.76 12.39 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 108.685 -1.766 . . . . 0.0 108.685 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 91.9 p -103.57 -145.23 0.37 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -1.081 . . . . 0.0 109.471 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -51.65 120.55 5.31 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.051 -1.031 . . . . 0.0 109.001 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.41 88.16 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.232 -0.918 . . . . 0.0 108.625 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 134.75 0.31 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.717 0.77 . . . . 0.0 109.939 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.86 ' HA ' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -44.74 148.79 0.48 Allowed 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.984 0.897 . . . . 0.0 111.929 -179.099 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.659 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -125.34 153.59 43.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.068 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.554 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 87.1 tttt -85.56 -33.69 21.66 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.554 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 7.3 mm-40 -164.54 -173.04 2.89 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-O 121.492 0.663 . . . . 0.0 109.632 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -62.79 -48.67 78.13 Favored 'General case' 0 C--O 1.184 -2.351 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.592 ' HZ1' ' CB ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -87.17 2.75 48.96 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 118.471 -1.292 . . . . 0.0 109.528 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.465 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 49.0 m-20 -93.29 4.24 54.31 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.678 -0.639 . . . . 0.0 111.97 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.659 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 1.3 m -84.57 155.94 21.85 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 120.297 -1.502 . . . . 0.0 107.167 179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 2' ' ' GLY . 89.0 m -47.2 166.75 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.916 -1.115 . . . . 0.0 109.215 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.61 130.45 44.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.198 -0.939 . . . . 0.0 110.106 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.793 ' O ' ' NE1' ' A' ' 35' ' ' TRP . . . 83.77 8.04 85.0 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 32' ' ' GLU . 61.4 m-85 -119.3 148.03 43.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.101 -1.235 . . . . 0.0 110.888 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.2 t30 -118.71 157.23 27.87 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.445 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 16.0 t -91.22 132.47 36.09 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.934 -1.103 . . . . 0.0 110.739 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -121.33 131.79 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.62 126.1 26.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.123 -0.985 . . . . 0.0 108.907 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.74 108.87 18.05 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.432 -0.793 . . . . 0.0 109.513 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.52 ' CG ' ' N ' ' A' ' 25' ' ' TYR . 5.9 p-90 -53.92 -39.16 65.6 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.102 -0.998 . . . . 0.0 109.324 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' N ' ' CG ' ' A' ' 24' ' ' TRP . 11.5 p90 -71.5 141.57 50.16 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.327 -0.949 . . . . 0.0 108.904 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.456 ' OD1' ' OE1' ' A' ' 28' ' ' GLN . 1.0 OUTLIER 70.22 -4.68 1.49 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER 57.62 16.93 3.68 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.777 -0.824 . . . . 0.0 108.777 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.456 ' OE1' ' OD1' ' A' ' 26' ' ' ASN . 98.6 mt-30 -113.59 -172.06 2.01 Favored 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.548 -1.345 . . . . 0.0 108.55 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.86 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 50.1 m -121.01 138.43 54.17 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -103.31 139.8 38.26 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 121.424 -0.798 . . . . 0.0 111.234 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 87.9 m -70.92 152.0 44.11 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.377 -0.827 . . . . 0.0 109.653 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -147.57 -156.82 0.75 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.555 ' N ' ' OE1' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -156.85 126.73 6.3 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 122.316 1.055 . . . . 0.0 108.793 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -127.98 24.46 6.02 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.793 ' NE1' ' O ' ' A' ' 17' ' ' GLY . 9.4 p-90 -119.35 -166.03 1.22 Allowed 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 -179.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.869 ' O ' ' HB2' ' A' ' 37' ' ' TYR . 24.7 tttt -172.06 39.59 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.071 -1.018 . . . . 0.0 109.709 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.869 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 11.5 m-85 108.06 32.96 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 123.147 0.579 . . . . 0.0 109.589 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.752 ' O ' ' HB2' ' A' ' 39' ' ' PHE . 81.6 mt -62.06 -44.26 97.07 Favored 'General case' 0 C--N 1.308 -1.237 0 O-C-N 120.664 -1.273 . . . . 0.0 108.882 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.752 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER 139.19 -170.65 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.5 ' O ' ' C ' ' A' ' 41' ' ' GLY . 69.6 p -76.76 -0.86 25.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.312 -0.868 . . . . 0.0 109.503 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.5 ' C ' ' O ' ' A' ' 40' ' ' THR . . . -34.83 -80.1 0.02 OUTLIER Glycine 0 N--CA 1.495 2.603 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.49 ' CD ' ' N ' ' A' ' 42' ' ' GLU . 1.4 pm0 -108.05 117.4 34.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.33 -1.1 . . . . 0.0 109.407 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.304 -1.41 0 O-C-N 120.853 -1.155 . . . . 0.0 108.614 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.479 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.442 0.639 . . . . 0.0 109.78 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.52 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -68.43 -51.23 32.9 Favored Glycine 0 N--CA 1.495 2.594 0 O-C-N 121.382 -0.824 . . . . 0.0 113.436 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.544 ' O ' ' C ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER 80.61 172.62 0.13 Allowed 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.075 -1.25 . . . . 0.0 110.244 -178.203 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.942 ' NZ ' ' HE ' ' A' ' 33' ' ' ARG . 46.4 tttp -28.77 129.56 0.07 Allowed 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.15 -0.969 . . . . 0.0 110.426 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 49.19 78.76 0.09 Allowed 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.52 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -171.39 135.87 0.97 Allowed 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.324 -1.35 . . . . 0.0 111.138 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.611 ' HA ' ' O ' ' A' ' 29' ' ' SER . 23.3 t90 -51.43 136.42 25.64 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.651 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.557 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -123.22 147.85 46.46 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 178.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.548 ' HB3' ' OD2' ' A' ' 13' ' ' ASP . 16.0 ttpt -88.94 -46.96 8.49 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.915 -1.115 . . . . 0.0 108.486 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.42 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 1.5 mm-40 -142.93 -179.36 6.31 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.483 ' CE ' ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -61.61 -36.05 79.6 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.678 -1.264 . . . . 0.0 110.181 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -80.72 -8.55 59.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.031 -1.043 . . . . 0.0 109.993 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.548 ' OD2' ' HB3' ' A' ' 9' ' ' LYS . 24.3 t0 -85.01 0.22 52.18 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.813 -1.179 . . . . 0.0 110.894 -179.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.557 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 5.3 m -88.64 142.87 27.33 Favored 'General case' 0 C--N 1.309 -1.193 0 O-C-N 120.121 -1.612 . . . . 0.0 108.028 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.53 ' SG ' ' HB2' ' A' ' 3' ' ' SER . 34.6 m -47.87 140.57 6.53 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.342 -0.849 . . . . 0.0 108.888 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.56 137.13 15.74 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.112 -0.993 . . . . 0.0 109.716 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.44 -0.73 78.18 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -124.83 144.95 50.02 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.29 -1.124 . . . . 0.0 110.063 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.516 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 t30 -100.24 153.61 19.13 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.473 -0.767 . . . . 0.0 110.127 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 41.9 t -91.15 114.58 27.15 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.537 0.684 . . . . 0.0 109.245 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.568 ' O ' ' HA ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -97.06 142.84 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.605 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -103.12 127.13 50.51 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.191 -0.943 . . . . 0.0 109.533 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.14 100.94 13.46 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.203 -0.936 . . . . 0.0 109.36 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.502 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 1.0 OUTLIER -44.14 -27.35 0.39 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.411 -0.806 . . . . 0.0 110.099 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.554 ' C ' ' H ' ' A' ' 27' ' ' GLN . 5.9 p90 -98.71 146.34 25.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.957 -1.089 . . . . 0.0 108.16 179.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 27' ' ' GLN . 1.1 m120 61.03 -3.43 0.16 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.359 -0.838 . . . . 0.0 109.348 -179.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.554 ' H ' ' C ' ' A' ' 25' ' ' TYR . 3.2 mp0 45.46 50.99 9.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.177 -0.952 . . . . 0.0 109.025 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.79 132.88 56.51 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.611 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 13.8 m -96.11 124.39 40.1 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.989 -1.069 . . . . 0.0 110.926 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.2 p -105.5 118.67 37.15 Favored 'General case' 0 C--N 1.31 -1.147 0 O-C-N 121.273 -0.892 . . . . 0.0 109.792 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.7 m -65.72 142.87 57.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.741 -1.224 . . . . 0.0 108.923 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -142.49 139.71 31.61 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.982 -1.074 . . . . 0.0 110.548 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.942 ' HE ' ' NZ ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -63.97 60.31 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.858 -0.526 . . . . 0.0 112.152 179.779 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' N ' ' O ' ' A' ' 32' ' ' GLU . 1.1 mmmp? -54.64 -2.98 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.236 -1.54 . . . . 0.0 110.627 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.66 ' C ' ' H ' ' A' ' 37' ' ' TYR . 12.9 m95 -118.61 -174.03 2.6 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.033 -1.042 . . . . 0.0 110.301 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.659 ' O ' ' N ' ' A' ' 38' ' ' LEU . 21.7 mmmt -57.6 16.54 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.341 -0.85 . . . . 0.0 111.782 -178.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.66 ' H ' ' C ' ' A' ' 35' ' ' TRP . 1.3 p90 48.04 -3.95 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.218 -0.926 . . . . 0.0 112.052 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.659 ' N ' ' O ' ' A' ' 36' ' ' LYS . 2.6 mt -96.76 -65.32 0.97 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 120.369 -1.457 . . . . 0.0 110.046 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.426 ' C ' ' HG1' ' A' ' 40' ' ' THR . 0.1 OUTLIER 178.51 -70.9 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.073 -1.017 . . . . 0.0 109.446 -178.715 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.426 ' HG1' ' C ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER 58.88 77.05 0.32 Allowed 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.228 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.11 178.22 41.49 Favored Glycine 0 N--CA 1.487 2.092 0 N-CA-C 108.848 -1.701 . . . . 0.0 108.848 -178.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -92.49 136.45 33.2 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.015 -1.285 . . . . 0.0 109.568 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.296 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.647 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.603 ' O ' ' HB3' ' A' ' 3' ' ' SER . . . -69.04 -59.19 6.06 Favored Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.925 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.603 ' HB3' ' O ' ' A' ' 2' ' ' GLY . 33.6 t 84.74 -165.28 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.785 -0.832 . . . . 0.0 110.549 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.405 ' N ' ' OG ' ' A' ' 3' ' ' SER . 68.6 tttt -51.64 132.2 30.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.626 -0.671 . . . . 0.0 109.318 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 53.37 78.6 0.14 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.435 ' HB1' ' C ' ' A' ' 2' ' ' GLY . . . -178.09 129.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.985 -1.072 . . . . 0.0 110.78 -178.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.476 ' HA ' ' O ' ' A' ' 29' ' ' SER . 38.4 t90 -52.78 117.52 2.99 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.511 -0.743 . . . . 0.0 110.219 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.648 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -109.32 150.66 27.68 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.731 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -92.5 -35.02 13.84 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.511 -1.368 . . . . 0.0 109.423 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.648 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -159.22 -170.16 2.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 109.029 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.64 ' HZ1' ' HZ1' ' A' ' 36' ' ' LYS . 5.7 tptm -60.64 -48.52 81.4 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.903 -1.123 . . . . 0.0 109.43 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -69.84 -41.99 74.19 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.542 -0.724 . . . . 0.0 111.678 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -54.29 -14.78 1.28 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.796 -1.19 . . . . 0.0 110.429 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.612 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 48.5 t -88.95 146.12 25.1 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.029 -1.044 . . . . 0.0 108.851 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.647 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.6 m -54.53 134.82 46.51 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.213 -178.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 123.96 16.23 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.25 -7.22 10.67 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.715 -1.754 . . . . 0.0 108.715 -179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.612 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 97.5 m-85 -125.38 150.98 46.73 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -1.067 . . . . 0.0 110.807 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.65 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 9.3 p-10 -96.57 133.1 41.48 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.0 t -93.4 125.93 38.26 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.354 -0.841 . . . . 0.0 109.763 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.517 ' CG1' ' O ' ' A' ' 21' ' ' VAL . 3.2 p -119.54 114.12 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -81.33 112.73 18.9 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.43 89.95 7.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.021 -1.049 . . . . 0.0 109.641 -178.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.687 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -47.11 -22.1 0.32 Allowed 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.814 -0.554 . . . . 0.0 110.903 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.448 ' H ' ' HD1' ' A' ' 24' ' ' TRP . 4.2 p90 -77.88 -45.18 24.96 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.516 -1.365 . . . . 0.0 111.267 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.938 ' ND2' ' H ' ' A' ' 28' ' ' GLN . 0.1 OUTLIER -103.64 9.2 37.43 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.366 -1.458 . . . . 0.0 109.721 178.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.575 ' N ' HD21 ' A' ' 26' ' ' ASN . 99.0 mm-40 57.3 15.07 2.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.607 -0.683 . . . . 0.0 111.245 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.938 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 77.4 mt-30 -119.07 138.66 52.72 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 120.961 -1.087 . . . . 0.0 109.909 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 4.3 m -96.2 131.16 42.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.032 -1.042 . . . . 0.0 109.612 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.3 t -117.43 104.15 10.82 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 121.439 -0.788 . . . . 0.0 109.957 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -64.59 153.92 37.83 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.833 -1.167 . . . . 0.0 110.056 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.65 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 94.6 mt-10 -144.12 137.3 27.4 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.363 -0.835 . . . . 0.0 110.177 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.626 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -73.13 85.35 1.35 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.501 ' HB2' ' CD1' ' A' ' 35' ' ' TRP . 17.2 mtpt -128.41 -24.16 3.11 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 119.97 -1.707 . . . . 0.0 108.959 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.642 ' O ' ' N ' ' A' ' 37' ' ' TYR . 5.9 m95 -121.59 -167.66 1.56 Allowed 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.64 ' HZ1' ' HZ1' ' A' ' 11' ' ' LYS . 2.3 mttm 36.05 24.13 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.818 -0.551 . . . . 0.0 110.02 178.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.673 ' O ' ' C ' ' A' ' 38' ' ' LEU . 8.7 t80 -101.04 -27.14 13.43 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.903 -1.123 . . . . 0.0 111.126 -178.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.673 ' C ' ' O ' ' A' ' 37' ' ' TYR . 0.1 OUTLIER 0.34 -119.72 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 121.267 0.556 . . . . 0.0 110.614 -179.429 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -60.43 -44.25 95.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.657 -1.277 . . . . 0.0 109.775 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.596 ' CG2' ' H ' ' A' ' 41' ' ' GLY . 0.7 OUTLIER -153.89 -97.66 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.915 0 CA-C-O 121.217 0.532 . . . . 0.0 109.806 -179.146 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.596 ' H ' ' CG2' ' A' ' 40' ' ' THR . . . -106.62 -96.04 2.44 Favored Glycine 0 N--CA 1.494 2.548 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.69 ' HG3' ' O ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER 64.0 107.55 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.132 -1.216 . . . . 0.0 108.703 -179.483 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 O-C-N 120.708 -1.245 . . . . 0.0 109.644 -179.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.513 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 24.7 p . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.58 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -79.36 132.2 11.25 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.319 -1.419 . . . . 0.0 109.673 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 31' ' ' CYS . 6.7 p -111.37 -158.62 0.65 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.417 -1.049 . . . . 0.0 108.905 179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' A' ' 3' ' ' SER . 14.1 tttt -37.33 119.83 0.73 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.104 -0.998 . . . . 0.0 109.423 -179.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.411 ' N ' ' OE2' ' A' ' 32' ' ' GLU . 21.1 mtt180 50.74 87.55 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.442 ' HB1' ' N ' ' A' ' 3' ' ' SER . . . -172.23 131.52 0.62 Allowed 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.764 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.647 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.4 t90 -44.51 135.73 4.61 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.118 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.577 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -129.98 148.7 51.86 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -95.34 -43.46 8.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.791 -1.193 . . . . 0.0 109.492 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.72 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 14.8 mt-10 -135.67 164.46 27.81 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.317 -0.864 . . . . 0.0 109.076 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.427 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.4 ttpt -55.59 -30.58 61.1 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.067 -1.021 . . . . 0.0 109.176 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.04 -8.33 51.76 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.992 -1.067 . . . . 0.0 109.436 179.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.569 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 10.7 t70 -78.73 -3.6 45.07 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.89 -1.131 . . . . 0.0 110.152 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 7.5 m -85.78 141.29 29.78 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 120.623 -1.298 . . . . 0.0 107.958 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 62.3 m -49.03 144.76 4.52 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.165 -0.959 . . . . 0.0 109.702 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.19 136.45 15.21 Favored 'General case' 0 C--O 1.166 -3.309 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 95.82 -1.29 63.36 Favored Glycine 0 N--CA 1.491 2.36 0 C-N-CA 117.397 -2.335 . . . . 0.0 109.663 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -137.76 145.34 42.32 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.078 -1.248 . . . . 0.0 109.682 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.627 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.0 p-10 -103.21 176.43 5.15 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.549 1.166 . . . . 0.0 108.133 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 23.4 m -98.45 128.6 44.88 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 119.999 -1.688 . . . . 0.0 109.983 177.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.441 ' HB ' ' O ' ' A' ' 30' ' ' SER . 2.2 t -122.16 120.39 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.539 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 9.3 t80 -78.28 120.3 22.85 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.321 -0.862 . . . . 0.0 109.105 -178.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -97.35 108.82 21.63 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.801 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 6.0 p90 -56.26 121.61 9.91 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.128 -0.983 . . . . 0.0 109.57 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.801 ' HB2' ' O ' ' A' ' 24' ' ' TRP . 2.5 t80 157.81 -79.56 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.053 -1.029 . . . . 0.0 109.203 178.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -110.21 22.68 15.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.437 -0.789 . . . . 0.0 109.742 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.539 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 52.0 mm-40 54.9 47.32 22.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.255 -0.903 . . . . 0.0 108.721 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -115.93 131.79 56.84 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.647 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 63.6 m -94.52 122.65 37.32 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.988 -1.07 . . . . 0.0 109.838 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.441 ' O ' ' HB ' ' A' ' 21' ' ' VAL . 30.6 p -97.12 113.99 25.62 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.021 -1.049 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.627 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.6 m -64.52 134.18 53.92 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.826 -1.172 . . . . 0.0 109.464 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.504 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 69.8 mm-40 -142.35 141.81 32.38 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.375 -0.828 . . . . 0.0 110.715 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.751 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.53 43.46 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.023 -1.048 . . . . 0.0 111.012 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 32' ' ' GLU . 12.3 mmtm -50.39 -9.46 0.05 OUTLIER 'General case' 0 C--N 1.292 -1.909 0 O-C-N 120.236 -1.54 . . . . 0.0 110.049 -179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.783 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -122.92 -150.02 0.44 Allowed 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.183 -0.948 . . . . 0.0 110.89 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.783 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 72.5 mttt 112.85 10.37 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 123.449 0.7 . . . . 0.0 110.195 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.465 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -132.54 10.5 4.39 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.638 -1.289 . . . . 0.0 111.117 -179.928 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.923 ' O ' ' N ' ' A' ' 40' ' ' THR . 13.5 tp -170.45 -120.2 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.53 -1.356 . . . . 0.0 110.34 179.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.523 ' O ' ' CB ' ' A' ' 40' ' ' THR . 34.6 m-85 32.48 -70.41 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.572 -0.705 . . . . 0.0 110.935 -179.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.923 ' N ' ' O ' ' A' ' 38' ' ' LEU . 0.2 OUTLIER 80.65 47.82 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.989 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.385 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.622 ' O ' ' HG2' ' A' ' 42' ' ' GLU . . . -74.1 32.76 0.93 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 110.019 -1.233 . . . . 0.0 110.019 -179.234 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.622 ' HG2' ' O ' ' A' ' 41' ' ' GLY . 2.0 pt-20 47.73 40.14 11.62 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.836 -0.802 . . . . 0.0 111.14 178.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 94.0 m . . . . . 0 C--N 1.298 -1.652 0 CA-C-O 118.001 -1.0 . . . . 0.0 109.769 179.783 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.524 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 14.7 p . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.11 0.481 . . . . 0.0 110.06 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.491 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -77.42 132.56 12.15 Favored Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.678 ' O ' ' C ' ' A' ' 4' ' ' LYS . 83.2 p -120.94 148.1 44.54 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.306 -1.114 . . . . 0.0 108.598 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.678 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER 4.77 113.27 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.454 0.645 . . . . 0.0 110.647 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.641 HH11 ' HB3' ' A' ' 5' ' ' ARG . 0.2 OUTLIER 60.22 87.15 0.09 Allowed 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 176.36 133.87 0.05 Allowed 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 110.114 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.767 ' HA ' ' O ' ' A' ' 29' ' ' SER . 24.3 t90 -51.44 130.05 26.58 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.505 0.669 . . . . 0.0 111.282 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.807 ' O ' ' HB2' ' A' ' 29' ' ' SER . 25.3 p -116.26 148.73 40.18 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -92.29 -46.19 7.83 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.408 -1.433 . . . . 0.0 109.123 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.429 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 1.3 mt-10 -154.11 -178.07 6.85 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -60.45 -43.53 96.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.596 -1.315 . . . . 0.0 109.755 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -71.53 -9.76 58.71 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.764 -1.21 . . . . 0.0 110.876 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.509 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 0.6 OUTLIER -99.46 8.71 44.33 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.921 -1.112 . . . . 0.0 110.078 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.621 ' SG ' ' CB ' ' A' ' 18' ' ' TYR . 16.3 t -101.25 135.11 43.27 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.422 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.0 OUTLIER -56.83 145.2 30.3 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.938 -1.101 . . . . 0.0 109.982 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.0 m -49.48 138.14 13.95 Favored 'General case' 1 C--O 1.152 -4.036 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.22 2.08 68.83 Favored Glycine 0 C--N 1.304 -1.243 0 N-CA-C 108.654 -1.778 . . . . 0.0 108.654 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.621 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 90.5 m-85 -137.11 149.39 47.3 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.503 -0.998 . . . . 0.0 110.545 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.727 HD22 ' HZ1' ' A' ' 34' ' ' LYS . 4.5 p-10 -108.64 163.16 13.49 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.482 -0.762 . . . . 0.0 109.528 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 t -106.21 134.15 49.8 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.228 -0.92 . . . . 0.0 110.033 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.1 p -138.82 141.46 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.145 -0.972 . . . . 0.0 109.701 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -84.41 127.18 33.86 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.061 -1.024 . . . . 0.0 110.508 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -95.6 95.06 8.11 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.442 -0.787 . . . . 0.0 109.434 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.514 ' O ' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -53.49 -40.55 65.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.415 -0.803 . . . . 0.0 110.766 -179.393 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 23' ' ' ALA . 51.4 p90 -63.01 -46.37 87.97 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.604 -1.31 . . . . 0.0 110.488 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.477 ' C ' ' H ' ' A' ' 28' ' ' GLN . 12.7 m-20 -92.88 1.53 57.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.86 -1.15 . . . . 0.0 109.23 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 24' ' ' TRP . 99.4 mm-40 56.53 6.3 0.27 Allowed 'General case' 0 C--O 1.158 -3.754 0 CA-C-O 123.998 1.856 . . . . 0.0 111.771 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.477 ' H ' ' C ' ' A' ' 26' ' ' ASN . 30.1 mt-30 -117.89 154.89 31.11 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 113.623 -1.626 . . . . 0.0 107.875 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.807 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.8 m -91.07 159.54 16.07 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 120.95 -1.094 . . . . 0.0 110.175 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -143.03 134.81 26.7 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 121.097 -1.002 . . . . 0.0 110.456 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 3.4 m -68.89 148.71 49.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.396 -0.815 . . . . 0.0 109.573 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.479 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 44.4 mm-40 -141.63 145.65 35.26 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.845 -1.159 . . . . 0.0 111.676 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.65 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -69.76 92.52 0.68 Allowed 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.09 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.727 ' HZ1' HD22 ' A' ' 19' ' ' ASN . 56.9 mttp -111.24 0.67 16.83 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 120.289 -1.507 . . . . 0.0 108.604 178.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.793 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -119.57 178.35 4.59 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -179.59 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.793 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 5.1 mmtt 103.55 22.64 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.688 ' O ' ' CB ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER -106.51 99.73 9.29 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.33 -0.856 . . . . 0.0 108.716 -179.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.688 ' CB ' ' O ' ' A' ' 37' ' ' TYR . 5.3 tp 133.97 -89.12 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.48 ' O ' ' OG1' ' A' ' 40' ' ' THR . 0.6 OUTLIER 179.41 34.64 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -179.807 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 39' ' ' PHE . 5.4 m -167.94 -118.18 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.205 -0.935 . . . . 0.0 109.332 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 115.15 151.04 9.94 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 108.718 -1.753 . . . . 0.0 108.718 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.479 ' O ' ' OXT' ' A' ' 43' ' ' CYS . 10.3 pt-20 -139.42 157.23 46.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.286 -1.126 . . . . 0.0 110.039 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.479 ' OXT' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 117.993 -1.003 . . . . 0.0 109.623 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 3' ' ' SER . 19.4 p . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 121.231 0.538 . . . . 0.0 109.83 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.498 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -53.86 89.11 0.01 OUTLIER Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.607 ' O ' ' O ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -110.95 104.0 12.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.246 -1.149 . . . . 0.0 109.479 -179.081 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.607 ' O ' ' O ' ' A' ' 3' ' ' SER . 33.5 tttt 49.39 108.96 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.925 0.869 . . . . 0.0 109.205 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.52 ' HG3' ' HG2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 50.78 83.39 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.263 -0.898 . . . . 0.0 108.61 -178.84 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.93 120.54 0.06 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.753 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.8 t90 -48.95 142.35 6.65 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.491 -0.756 . . . . 0.0 111.482 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.462 ' N ' ' CD1' ' A' ' 7' ' ' TRP . 3.0 p -125.64 148.72 48.89 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.439 ' HB3' ' CB ' ' A' ' 13' ' ' ASP . 81.1 tttt -86.01 -28.18 24.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.093 -1.005 . . . . 0.0 108.832 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.775 ' HG3' ' H ' ' A' ' 11' ' ' LYS . 19.2 tp10 -170.28 -157.35 0.15 Allowed 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.775 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 6.3 tmtt? -69.39 -49.03 59.18 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.356 0.598 . . . . 0.0 109.659 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.42 ' HA ' ' HZ2' ' A' ' 11' ' ' LYS . 16.7 tttm -69.29 -45.56 69.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.441 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.534 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 9.9 t70 -53.83 -9.05 0.2 Allowed 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.463 -0.773 . . . . 0.0 110.535 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.71 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -94.19 150.54 20.22 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.914 -1.116 . . . . 0.0 108.342 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.731 ' O ' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER -60.54 133.77 56.42 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.24 -0.913 . . . . 0.0 110.955 -178.379 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.657 ' N ' ' HB2' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -48.78 66.46 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 CA-C-O 121.533 0.682 . . . . 0.0 110.954 179.482 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.731 ' N ' ' O ' ' A' ' 15' ' ' CYS . . . 179.05 -29.17 0.06 OUTLIER Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.206 -1.958 . . . . 0.0 108.206 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.71 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 94.1 m-85 -108.29 153.75 22.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.707 -0.878 . . . . 0.0 110.19 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.712 ' C ' ' SG ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -101.83 134.09 45.55 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.55 -0.719 . . . . 0.0 109.263 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.7 t -80.52 121.51 25.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.985 -1.072 . . . . 0.0 109.938 -179.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.442 ' CG2' ' OD1' ' A' ' 19' ' ' ASN . 41.4 t -126.55 132.56 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.517 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 62.2 t80 -70.97 131.31 43.5 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.399 178.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.824 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -86.18 81.5 8.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 120.988 -1.07 . . . . 0.0 108.956 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.564 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -54.34 -36.83 64.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.272 -0.892 . . . . 0.0 111.123 -178.934 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.781 ' CE2' ' ND2' ' A' ' 26' ' ' ASN . 51.0 p90 -71.93 -27.08 62.57 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.648 -1.282 . . . . 0.0 110.997 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.781 ' ND2' ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -133.56 13.13 4.11 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.776 -1.202 . . . . 0.0 109.121 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.824 ' N ' ' O ' ' A' ' 23' ' ' ALA . 79.4 mm-40 63.93 -163.41 0.26 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.436 0.636 . . . . 0.0 110.724 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 59.93 -174.5 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.318 -0.864 . . . . 0.0 109.487 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.753 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 3.2 m -132.67 121.77 23.64 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.235 -0.916 . . . . 0.0 108.856 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -114.62 113.28 24.16 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.218 -0.926 . . . . 0.0 109.966 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.712 ' SG ' ' C ' ' A' ' 19' ' ' ASN . 0.7 OUTLIER -67.01 146.51 54.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.419 -0.913 . . . . 0.0 110.299 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -142.06 152.31 43.21 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.292 -0.88 . . . . 0.0 109.441 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.511 HH11 ' H ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -50.59 153.08 1.75 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.854 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.99 65.39 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.295 0 O-C-N 120.779 -1.201 . . . . 0.0 109.611 -179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.718 ' C ' ' H ' ' A' ' 37' ' ' TYR . 93.5 m95 -122.43 -31.24 3.82 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.156 -0.965 . . . . 0.0 110.195 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.432 ' H ' ' NH1' ' A' ' 33' ' ' ARG . 68.2 mttm 53.4 -9.78 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.615 -0.678 . . . . 0.0 111.145 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.718 ' H ' ' C ' ' A' ' 35' ' ' TRP . 66.3 m-85 -107.3 15.6 24.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.16 -0.963 . . . . 0.0 109.25 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.677 ' O ' ' C ' ' A' ' 39' ' ' PHE . 0.5 OUTLIER 76.01 -47.79 0.57 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.609 -0.682 . . . . 0.0 109.449 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.677 ' C ' ' O ' ' A' ' 38' ' ' LEU . 5.0 t80 -4.84 -93.99 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.734 -0.604 . . . . 0.0 111.078 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.432 ' C ' ' O ' ' A' ' 39' ' ' PHE . 43.6 p 38.39 -151.21 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.465 -0.772 . . . . 0.0 110.707 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.864 ' O ' ' O ' ' A' ' 42' ' ' GLU . . . 92.05 70.33 1.17 Allowed Glycine 0 N--CA 1.495 2.631 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.864 ' O ' ' O ' ' A' ' 41' ' ' GLY . 1.3 pm0 40.42 139.33 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 122.007 -0.702 . . . . 0.0 109.966 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.657 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.301 -1.53 0 O-C-N 120.534 -1.354 . . . . 0.0 108.792 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 15.8 p . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.558 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -76.19 149.84 38.03 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 119.517 -1.325 . . . . 0.0 110.422 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.693 ' O ' ' N ' ' A' ' 5' ' ' ARG . 3.9 m -110.13 -162.57 0.81 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.275 -1.133 . . . . 0.0 109.861 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.756 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 3.6 tttm -58.53 54.23 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.5 -0.75 . . . . 0.0 110.327 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.693 ' N ' ' O ' ' A' ' 3' ' ' SER . 33.7 ptt-85 137.55 76.59 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.662 0.744 . . . . 0.0 109.144 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.0 146.77 0.89 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.187 -0.946 . . . . 0.0 110.512 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.734 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.1 t90 -47.83 151.11 0.95 Allowed 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.185 0.993 . . . . 0.0 111.746 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER -121.98 153.58 38.35 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.047 -179.597 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -110.8 -29.51 7.94 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.992 -1.067 . . . . 0.0 109.057 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.621 ' HG2' ' H ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -168.79 -173.23 1.8 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.336 -0.852 . . . . 0.0 109.28 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.621 ' H ' ' HG2' ' A' ' 10' ' ' GLU . 6.6 ttmt -66.59 -49.45 66.3 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.199 -0.601 . . . . 0.0 112.187 -178.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -83.95 -10.81 57.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.476 -1.39 . . . . 0.0 109.054 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.433 ' HB2' ' N ' ' A' ' 10' ' ' GLU . 50.3 m-20 -71.78 -3.88 24.58 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.89 179.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 30.5 t -85.56 149.62 25.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.872 -1.142 . . . . 0.0 108.773 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 64.7 m -57.05 147.65 23.71 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.352 -0.843 . . . . 0.0 109.324 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -52.32 134.15 34.11 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.396 -0.815 . . . . 0.0 109.225 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.449 ' N ' ' HB3' ' A' ' 43' ' ' CYS . . . 94.47 -0.99 66.12 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.625 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 79.7 m-85 -134.17 150.25 51.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.234 -1.156 . . . . 0.0 110.55 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.04 150.82 25.38 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 2.8 m -94.0 138.27 32.28 Favored 'General case' 0 N--CA 1.403 -2.823 1 O-C-N 116.281 -4.012 . . . . 0.0 109.931 175.494 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.1 t -135.12 137.96 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.447 -0.783 . . . . 0.0 110.824 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.4 103.83 1.39 Allowed 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.696 ' O ' ' C ' ' A' ' 24' ' ' TRP . . . -93.76 -161.74 0.88 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.731 ' C ' ' H ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 14.07 94.93 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.95 0.881 . . . . 0.0 109.47 -178.977 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -49.26 3.42 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.68 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.845 HD21 ' H ' ' A' ' 26' ' ' ASN . 0.1 OUTLIER -81.34 -56.03 4.32 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.277 -0.889 . . . . 0.0 108.824 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.741 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 172.72 37.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.224 1.011 . . . . 0.0 108.652 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.439 ' HB3' ' HB2' ' A' ' 24' ' ' TRP . 56.4 tp60 -121.57 157.38 30.86 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.586 -1.321 . . . . 0.0 110.547 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.734 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 2.6 m -133.32 150.57 51.86 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 t -143.5 136.44 27.65 Favored 'General case' 0 C--N 1.309 -1.185 0 O-C-N 121.078 -1.013 . . . . 0.0 110.529 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 1.5 m -67.09 144.36 56.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.448 -0.783 . . . . 0.0 109.641 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -148.17 139.07 23.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.553 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.697 ' NE ' ' HE1' ' A' ' 35' ' ' TRP . 0.7 OUTLIER -57.94 175.41 0.2 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.121 -0.987 . . . . 0.0 109.384 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.545 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER 178.54 99.36 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.351 0 O-C-N 120.623 -1.298 . . . . 0.0 109.925 179.763 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.697 ' HE1' ' NE ' ' A' ' 33' ' ' ARG . 7.7 p-90 -120.15 167.96 11.71 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.586 -0.696 . . . . 0.0 109.673 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 35' ' ' TRP . 0.3 OUTLIER 80.29 -9.77 1.35 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 -179.149 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.776 ' O ' ' HB2' ' A' ' 38' ' ' LEU . 32.4 p90 -73.21 49.28 0.26 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.382 -0.824 . . . . 0.0 109.377 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.776 ' HB2' ' O ' ' A' ' 37' ' ' TYR . 72.7 mt 96.39 137.04 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.88 43.73 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.591 -0.693 . . . . 0.0 110.031 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.633 ' N ' ' O ' ' A' ' 38' ' ' LEU . 16.1 p -74.77 166.48 23.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.499 -1.376 . . . . 0.0 109.463 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -56.26 -175.05 0.21 Allowed Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -137.46 165.68 25.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -1.097 . . . . 0.0 109.456 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.449 ' HB3' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 O-C-N 121.25 -0.906 . . . . 0.0 109.016 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.564 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 22.0 p . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.645 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -76.6 122.61 6.41 Favored Glycine 0 N--CA 1.486 2.014 0 C-N-CA 118.669 -1.729 . . . . 0.0 108.929 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.697 ' O ' ' C ' ' A' ' 4' ' ' LYS . 14.9 m -98.97 175.21 6.0 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.285 . . . . 0.0 108.148 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.697 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER -25.72 128.38 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.176 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 4' ' ' LYS . 14.4 ttp180 60.33 82.19 0.16 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.224 -0.923 . . . . 0.0 109.134 -178.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HB1' ' O ' ' A' ' 5' ' ' ARG . . . 176.44 129.02 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.226 -0.921 . . . . 0.0 110.582 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.568 ' HA ' ' O ' ' A' ' 29' ' ' SER . 2.0 t90 -44.66 133.25 6.04 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.572 0.701 . . . . 0.0 110.565 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.681 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 27.6 p -114.12 135.23 54.26 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -90.03 -37.04 14.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.618 -1.301 . . . . 0.0 109.487 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.429 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 0.2 OUTLIER -146.37 177.85 8.7 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.3 -0.875 . . . . 0.0 108.846 178.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -61.4 -45.5 94.09 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.328 0.585 . . . . 0.0 110.074 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -81.06 -15.52 55.83 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 119.667 -1.895 . . . . 0.0 112.214 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.429 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -71.81 -7.79 50.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.105 -0.997 . . . . 0.0 111.243 -178.286 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.51 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 51.3 m -88.13 142.79 27.48 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.446 -1.409 . . . . 0.0 107.758 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.496 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -53.09 148.97 7.27 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.542 -178.523 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.589 ' HA ' ' HB3' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -49.17 120.19 3.82 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.134 0.968 . . . . 0.0 109.746 -178.851 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.94 -1.27 35.74 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 4' ' ' LYS . 82.7 m-85 -131.15 144.82 51.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.449 -1.03 . . . . 0.0 108.587 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.573 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 9.2 p-10 -118.31 169.08 10.03 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.028 -1.045 . . . . 0.0 110.333 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.1 t -89.45 128.42 35.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.667 -0.645 . . . . 0.0 109.436 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.5 t -127.71 130.74 70.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.367 -0.833 . . . . 0.0 109.459 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -72.79 118.38 15.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.181 -0.949 . . . . 0.0 109.066 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -89.94 95.16 10.1 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.412 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p-90 -52.87 -40.46 63.45 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.523 -0.736 . . . . 0.0 110.517 -178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.642 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.4 OUTLIER -73.9 136.56 43.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.854 -1.154 . . . . 0.0 108.606 179.873 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER 55.95 13.22 1.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.28 -0.888 . . . . 0.0 109.07 -178.389 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.425 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 2.0 mp0 50.51 -155.53 0.12 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.408 -0.808 . . . . 0.0 109.888 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.894 HE21 ' H ' ' A' ' 29' ' ' SER . 1.7 tp60 63.56 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.261 -0.899 . . . . 0.0 110.062 -179.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.894 ' H ' HE21 ' A' ' 28' ' ' GLN . 70.6 m -100.9 157.03 17.03 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.334 178.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.6 t -136.69 139.06 41.69 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.233 -0.917 . . . . 0.0 110.653 -179.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.681 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 91.3 m -66.87 148.24 52.2 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.494 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 4.6 pt-20 -144.25 139.69 28.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.972 -1.08 . . . . 0.0 108.982 178.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.534 ' NH1' ' NE1' ' A' ' 35' ' ' TRP . 3.9 ttm180 -64.21 155.01 33.15 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.311 -0.868 . . . . 0.0 110.735 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.59 70.88 0.47 Allowed 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.608 ' O ' ' CD1' ' A' ' 35' ' ' TRP . 0.2 OUTLIER -112.36 131.07 55.73 Favored 'General case' 0 C--N 1.289 -2.06 0 CA-C-O 122.321 1.057 . . . . 0.0 110.036 -179.479 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -60.14 -36.08 76.72 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.674 ' CG ' ' O ' ' A' ' 37' ' ' TYR . 42.3 t80 155.89 27.9 0.0 OUTLIER 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 115.192 -0.913 . . . . 0.0 108.632 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.652 ' N ' HD13 ' A' ' 38' ' ' LEU . 0.0 OUTLIER -177.97 -175.77 0.51 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.222 -0.924 . . . . 0.0 109.866 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.552 ' N ' ' CD2' ' A' ' 38' ' ' LEU . 48.4 m-85 -32.1 120.6 0.29 Allowed 'General case' 0 N--CA 1.499 2.021 0 CA-C-O 121.702 0.763 . . . . 0.0 111.528 -178.396 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.71 34.47 0.39 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.273 -0.892 . . . . 0.0 109.237 178.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 73.91 -134.61 18.96 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.065 -1.614 . . . . 0.0 109.065 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -137.71 154.14 49.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.155 -1.203 . . . . 0.0 109.577 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.589 ' HB3' ' HA ' ' A' ' 16' ' ' CYS . 8.5 p . . . . . 0 C--N 1.303 -1.444 0 CA-C-O 118.008 -0.996 . . . . 0.0 109.618 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.719 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.674 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -73.57 150.17 42.9 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.464 ' O ' ' C ' ' A' ' 4' ' ' LYS . 50.2 m -105.26 -170.2 1.71 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.355 -1.085 . . . . 0.0 109.505 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.464 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.6 OUTLIER -37.52 121.84 0.89 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.219 -0.925 . . . . 0.0 109.91 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.612 ' N ' ' O ' ' A' ' 31' ' ' CYS . 42.5 ttp180 48.89 86.05 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 178.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.476 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -173.03 124.23 0.42 Allowed 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 121.975 0.893 . . . . 0.0 109.668 -178.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.683 ' HA ' ' O ' ' A' ' 29' ' ' SER . 34.7 t90 -24.54 142.67 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.21 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.661 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -130.95 157.08 43.91 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.731 0.777 . . . . 0.0 110.574 179.379 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.468 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 30.5 mttm -88.49 -40.82 13.16 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 177.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 51.1 mm-40 -159.41 -173.65 4.28 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 121.541 0.686 . . . . 0.0 109.173 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.555 ' HG3' ' OD1' ' A' ' 19' ' ' ASN . 53.5 tttm -67.94 -45.82 73.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.363 -0.836 . . . . 0.0 109.986 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -12.83 60.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.529 -0.732 . . . . 0.0 110.099 -178.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.431 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 12.4 m-20 -85.4 2.58 43.82 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.045 -1.034 . . . . 0.0 111.549 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.525 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 3.8 m -85.38 143.38 28.67 Favored 'General case' 0 C--N 1.308 -1.237 0 O-C-N 120.428 -1.42 . . . . 0.0 108.408 179.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.719 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 11.0 m -54.56 138.92 39.69 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.323 -0.861 . . . . 0.0 108.708 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 44.4 t -34.12 148.49 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.482 ' CA ' ' HB3' ' A' ' 43' ' ' CYS . . . 74.94 1.38 62.53 Favored Glycine 0 N--CA 1.493 2.44 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.645 ' HB3' ' HB3' ' A' ' 31' ' ' CYS . 62.8 m-85 -135.93 156.57 48.57 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.5 -1.589 . . . . 0.0 111.157 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 1.055 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 32.1 t30 -131.05 169.24 16.13 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.727 . . . . 0.0 110.391 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.413 ' N ' ' CG ' ' A' ' 19' ' ' ASN . 6.3 t -90.35 109.08 20.2 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.915 -1.116 . . . . 0.0 109.94 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -103.58 134.22 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.493 -0.754 . . . . 0.0 109.797 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.536 ' CD2' ' O ' ' A' ' 23' ' ' ALA . 65.4 t80 -67.91 141.49 56.35 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.044 -1.035 . . . . 0.0 108.966 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.536 ' O ' ' CD2' ' A' ' 22' ' ' TYR . . . -85.52 -148.82 0.12 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.299 -0.876 . . . . 0.0 110.01 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.416 ' CZ3' ' O ' ' A' ' 22' ' ' TYR . 0.8 OUTLIER -175.01 -49.0 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.253 -179.336 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.579 ' CE1' ' ND2' ' A' ' 26' ' ' ASN . 4.2 p90 -86.78 -34.29 19.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.61 -1.307 . . . . 0.0 108.375 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.812 HD21 ' H ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -109.57 10.34 25.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.478 -0.764 . . . . 0.0 109.361 178.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.433 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 98.6 mm-40 54.59 -167.22 0.08 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.101 -0.999 . . . . 0.0 110.77 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.409 ' HG3' ' H ' ' A' ' 29' ' ' SER . 15.6 tp60 64.06 -168.36 0.21 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.537 -0.727 . . . . 0.0 109.274 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.683 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 58.9 m -131.84 147.15 52.46 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.365 -0.834 . . . . 0.0 109.441 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.8 p -128.37 143.11 50.96 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 1.055 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 77.7 m -67.63 148.08 51.85 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.006 -1.059 . . . . 0.0 109.874 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -147.71 149.7 32.93 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.117 -0.989 . . . . 0.0 110.275 179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.79 135.51 57.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.625 -1.297 . . . . 0.0 109.26 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -87.35 0.72 55.02 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.241 -0.912 . . . . 0.0 111.877 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.602 ' O ' ' HG2' ' A' ' 36' ' ' LYS . 5.4 m95 54.26 -167.97 0.07 Allowed 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 -177.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.602 ' HG2' ' O ' ' A' ' 35' ' ' TRP . 50.0 mmtt -164.81 -41.12 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.884 -1.135 . . . . 0.0 108.977 177.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.551 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 59.0 t80 173.66 -21.14 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.205 179.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -164.55 -158.35 0.41 Allowed 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.217 -0.927 . . . . 0.0 110.32 -179.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -55.79 -44.13 77.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.233 -0.917 . . . . 0.0 109.893 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.8 m -71.47 155.67 40.32 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 121.335 -0.853 . . . . 0.0 108.779 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 134.72 17.3 0.95 Allowed Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.441 ' HG2' ' HXT' ' A' ' 43' ' ' CYS . 76.4 tt0 -95.47 126.01 40.47 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.151 -1.205 . . . . 0.0 108.708 179.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.482 ' HB3' ' CA ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.599 -179.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.631 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 121.171 0.51 . . . . 0.0 109.689 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.697 ' C ' ' HB1' ' A' ' 6' ' ' ALA . . . -59.51 -89.99 0.02 OUTLIER Glycine 0 N--CA 1.494 2.513 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.287 -178.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 1.3 t 87.13 -173.78 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.683 -0.893 . . . . 0.0 110.54 -178.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.524 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 71.5 tttt -43.66 126.64 4.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.569 -0.707 . . . . 0.0 109.842 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.524 ' HG2' ' HG2' ' A' ' 4' ' ' LYS . 0.4 OUTLIER 46.92 81.26 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -177.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.697 ' HB1' ' C ' ' A' ' 2' ' ' GLY . . . -178.81 126.78 0.1 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.242 -177.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.788 ' HA ' ' O ' ' A' ' 29' ' ' SER . 31.8 t90 -52.77 137.74 30.85 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.662 0.744 . . . . 0.0 111.692 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.707 ' SG ' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -122.03 170.98 9.3 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.478 178.405 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.707 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -121.98 -36.8 2.94 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.521 -1.362 . . . . 0.0 108.041 177.871 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.728 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 44.6 mt-10 -148.36 169.51 20.0 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 tptm -59.05 -23.77 62.28 Favored 'General case' 0 C--N 1.292 -1.893 0 O-C-N 121.076 -1.015 . . . . 0.0 108.72 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -93.33 -33.98 13.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.612 -0.68 . . . . 0.0 111.282 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.402 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -63.74 -6.98 6.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.006 -1.059 . . . . 0.0 110.58 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.709 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.4 t -93.96 160.77 14.58 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.497 -0.752 . . . . 0.0 108.998 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.631 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 94.1 m -56.78 140.0 49.14 Favored 'General case' 0 C--N 1.306 -1.312 0 O-C-N 120.985 -1.072 . . . . 0.0 109.108 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.43 129.31 41.24 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.508 ' O ' ' CD1' ' A' ' 35' ' ' TRP . . . 104.0 -4.14 45.26 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.887 ' C ' ' HE1' ' A' ' 35' ' ' TRP . 95.3 m-85 -117.99 141.18 48.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.942 -1.328 . . . . 0.0 109.32 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.833 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 5.3 p-10 -90.91 144.03 26.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.323 -0.86 . . . . 0.0 108.739 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.728 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 18.0 m -90.31 136.29 33.14 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.576 0.703 . . . . 0.0 111.253 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.434 ' O ' ' HA ' ' A' ' 29' ' ' SER . 41.9 t -117.25 101.48 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -73.85 114.46 12.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.338 -0.851 . . . . 0.0 109.42 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.65 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -94.93 88.81 5.4 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.279 -0.888 . . . . 0.0 110.506 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.621 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -51.86 -2.05 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.384 -0.823 . . . . 0.0 109.941 178.489 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.65 ' H ' ' C ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -60.37 -49.31 78.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.083 -1.011 . . . . 0.0 109.637 -179.047 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.541 ' ND2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -151.27 46.75 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.234 -0.916 . . . . 0.0 109.286 179.464 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 52.28 37.95 23.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.466 -0.771 . . . . 0.0 110.165 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.474 ' O ' ' CB ' ' A' ' 23' ' ' ALA . 8.3 tt0 -120.36 114.14 21.4 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.21 -0.931 . . . . 0.0 109.513 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.788 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.7 m -95.24 172.37 8.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.948 -1.095 . . . . 0.0 109.277 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 20' ' ' CYS . 1.6 t -144.56 -157.81 0.82 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.236 -0.915 . . . . 0.0 109.849 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.833 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -165.73 138.49 4.21 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.018 -179.729 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -145.2 144.25 30.74 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.695 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 1.1 ptp85 -57.57 110.27 0.85 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.151 -0.968 . . . . 0.0 111.45 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -155.12 56.3 0.65 Allowed 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 178.143 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.887 ' HE1' ' C ' ' A' ' 18' ' ' TYR . 39.9 m95 -114.01 -13.05 12.53 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.577 -0.702 . . . . 0.0 111.347 -178.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.445 ' C ' ' O ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER 42.01 9.87 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.214 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.741 ' N ' ' O ' ' A' ' 35' ' ' TRP . 67.5 m-85 -106.47 47.7 0.87 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.957 -1.09 . . . . 0.0 109.042 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.24 -33.24 74.21 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.504 -0.748 . . . . 0.0 109.215 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -53.99 -45.3 71.39 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.451 -0.78 . . . . 0.0 109.089 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.501 HG22 ' H ' ' A' ' 42' ' ' GLU . 14.6 m -76.39 161.42 28.7 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -117.39 10.18 14.78 Favored Glycine 0 N--CA 1.499 2.838 0 C-N-CA 119.843 -1.17 . . . . 0.0 110.719 -179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.501 ' H ' HG22 ' A' ' 40' ' ' THR . 13.4 pt-20 -138.08 -177.78 4.98 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.948 -1.325 . . . . 0.0 109.321 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.302 -1.499 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.289 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.503 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 19.4 p . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.626 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -88.41 114.7 4.27 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.41 -1.376 . . . . 0.0 109.892 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 4' ' ' LYS . 3.6 m -94.31 -159.52 0.71 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.142 -1.211 . . . . 0.0 107.736 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 11.6 tmtt? -46.9 147.54 1.31 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.426 -1.421 . . . . 0.0 108.286 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.564 ' CG ' ' O ' ' A' ' 5' ' ' ARG . 8.1 ptm180 39.2 78.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.563 1.173 . . . . 0.0 109.286 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.71 125.96 0.08 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.442 -0.787 . . . . 0.0 109.266 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.665 ' HA ' ' O ' ' A' ' 29' ' ' SER . 72.5 t90 -45.06 134.1 6.19 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.578 0.704 . . . . 0.0 111.729 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -123.83 136.03 54.13 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.441 ' HB3' ' CG ' ' A' ' 13' ' ' ASP . 31.0 tttm -82.73 -40.87 19.97 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.696 ' CG ' ' H ' ' A' ' 11' ' ' LYS . 62.8 tt0 -156.55 179.58 9.12 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.696 ' H ' ' CG ' ' A' ' 10' ' ' GLU . 1.6 ttpm? -58.87 -43.96 90.96 Favored 'General case' 0 C--N 1.285 -2.214 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.874 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -69.63 -37.79 76.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.358 -0.839 . . . . 0.0 110.582 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.441 ' CG ' ' HB3' ' A' ' 9' ' ' LYS . 10.3 t70 -60.34 -23.47 64.27 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.779 -1.201 . . . . 0.0 110.577 -178.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.73 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.3 t -79.56 142.96 35.24 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.024 -1.048 . . . . 0.0 108.833 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -51.47 121.95 7.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.835 0.826 . . . . 0.0 109.429 -177.759 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' CYS . 1.3 t -38.1 137.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.274 0.559 . . . . 0.0 109.523 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.614 ' N ' ' SG ' ' A' ' 43' ' ' CYS . . . 100.79 -14.24 58.96 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.73 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 67.7 m-85 -111.23 150.47 29.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.994 -1.298 . . . . 0.0 110.312 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.606 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.9 t30 -97.46 132.24 43.35 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.442 -0.787 . . . . 0.0 109.93 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 5.3 m -85.94 143.01 28.41 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.276 -0.89 . . . . 0.0 109.863 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -134.61 143.57 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -109.94 111.78 23.38 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 108.717 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.636 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -89.64 93.36 9.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.914 -1.116 . . . . 0.0 109.264 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -54.23 -38.14 65.4 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.403 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.611 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -60.37 -46.65 89.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.947 -1.096 . . . . 0.0 108.931 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.434 ' C ' ' H ' ' A' ' 28' ' ' GLN . 81.1 m-20 -92.45 -6.75 49.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.191 -0.943 . . . . 0.0 108.8 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.636 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER 58.72 6.48 0.62 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.432 -0.793 . . . . 0.0 109.474 -179.831 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.434 ' H ' ' C ' ' A' ' 26' ' ' ASN . 29.1 mm100 -109.99 137.19 48.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.346 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.665 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.4 m -93.82 144.5 25.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.083 -1.011 . . . . 0.0 108.427 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.6 p -142.93 127.98 18.51 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.372 -0.83 . . . . 0.0 109.776 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.606 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -69.85 160.45 31.77 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.342 -0.849 . . . . 0.0 110.545 -179.945 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -145.18 141.28 28.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.541 -0.724 . . . . 0.0 109.057 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.449 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -70.19 128.94 37.99 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.594 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 94.5 mttt -158.2 27.13 0.25 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 120.856 -1.152 . . . . 0.0 109.855 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.507 ' C ' ' H ' ' A' ' 37' ' ' TYR . 88.9 m95 -116.86 -1.43 12.02 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.291 -0.88 . . . . 0.0 109.752 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.25 -10.92 0.09 Allowed 'General case' 0 C--N 1.296 -1.718 0 O-C-N 121.75 -0.594 . . . . 0.0 109.814 -178.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.507 ' H ' ' C ' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -112.73 41.49 2.04 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.991 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.452 HD21 ' HA ' ' A' ' 38' ' ' LEU . 0.2 OUTLIER -145.62 153.7 41.33 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.184 -0.947 . . . . 0.0 108.682 179.724 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.529 ' O ' ' C ' ' A' ' 40' ' ' THR . 44.3 t80 -46.34 114.44 0.8 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.132 -0.98 . . . . 0.0 108.981 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.529 ' C ' ' O ' ' A' ' 39' ' ' PHE . 9.9 m 31.8 -117.43 0.05 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.323 0.583 . . . . 0.0 110.173 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.535 ' C ' ' HG2' ' A' ' 42' ' ' GLU . . . -159.31 -29.65 0.02 OUTLIER Glycine 0 N--CA 1.485 1.948 0 C-N-CA 119.97 -1.11 . . . . 0.0 110.348 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.535 ' HG2' ' C ' ' A' ' 41' ' ' GLY . 1.6 pm0 35.54 67.7 0.26 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.243 -1.151 . . . . 0.0 108.912 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.614 ' SG ' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER . . . . . 0 C--N 1.301 -1.519 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.355 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.543 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 25.5 p . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.99 129.94 9.82 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 4' ' ' LYS . 29.6 m -99.28 -170.48 1.92 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -1.114 . . . . 0.0 108.541 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' A' ' 3' ' ' SER . 48.4 tttm -46.87 128.73 11.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.555 -1.341 . . . . 0.0 107.565 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 62.09 79.36 0.26 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.361 -0.935 . . . . 0.0 108.635 -178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.55 129.97 0.1 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.246 -0.908 . . . . 0.0 109.927 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.795 ' HA ' ' O ' ' A' ' 29' ' ' SER . 45.4 t90 -53.27 138.47 32.16 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.424 0.63 . . . . 0.0 111.961 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.557 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -122.2 160.68 24.68 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.505 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.497 ' N ' ' OD2' ' A' ' 13' ' ' ASP . 18.3 tttt -85.78 -45.83 11.24 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.285 -0.884 . . . . 0.0 109.202 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.597 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 93.1 mt-10 -145.19 -167.34 2.65 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.661 0.744 . . . . 0.0 109.263 -179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 tptt -62.67 -40.92 98.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.829 -0.545 . . . . 0.0 110.253 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -87.52 -3.07 59.0 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.112 -0.993 . . . . 0.0 110.761 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.597 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 24.8 t70 -80.93 -3.6 52.04 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.874 -1.141 . . . . 0.0 111.951 -177.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 34.2 m -86.09 145.08 27.2 Favored 'General case' 0 C--N 1.308 -1.233 0 O-C-N 120.298 -1.501 . . . . 0.0 108.862 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.543 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 72.5 m -51.39 161.67 0.43 Allowed 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 -179.059 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -58.33 137.55 57.11 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.41 4.3 87.98 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -130.95 141.53 50.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -1.205 . . . . 0.0 110.414 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 31.3 p-10 -104.36 166.91 10.09 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.936 -1.102 . . . . 0.0 109.181 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 18.8 t -102.81 130.69 49.88 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.239 -0.913 . . . . 0.0 109.569 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.05 128.55 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -79.3 123.75 27.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.082 -1.012 . . . . 0.0 109.121 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.578 ' HB1' ' CE2' ' A' ' 25' ' ' TYR . . . -101.57 74.2 1.5 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.285 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.1 p-90 -54.55 -36.06 63.91 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.094 -1.004 . . . . 0.0 109.786 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.578 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -56.64 -26.07 55.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.0 109.361 -179.723 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.557 ' ND2' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -141.73 28.85 1.75 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.947 . . . . 0.0 108.897 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 23' ' ' ALA . 5.9 mp0 48.89 -171.0 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.523 -0.736 . . . . 0.0 109.23 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.46 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER 57.87 153.93 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.36 -0.838 . . . . 0.0 110.196 179.533 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.795 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 40.4 m -114.69 132.76 56.3 Favored 'General case' 1 C--O 1.148 -4.243 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.328 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.7 p -107.91 127.09 53.44 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.591 0.71 . . . . 0.0 110.75 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 79.9 m -71.66 148.92 46.03 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.443 -0.786 . . . . 0.0 110.263 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.501 ' O ' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -147.02 149.56 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.73 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.616 ' O ' ' CB ' ' A' ' 34' ' ' LYS . 10.4 ptt180 -51.93 -165.24 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.055 -1.028 . . . . 0.0 111.66 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.616 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 91.7 mttt . . . . . 0 N--CA 1.498 1.971 0 C-N-CA 123.592 0.757 . . . . 0.0 109.807 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.513 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 28.8 p . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.637 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -73.29 118.45 6.27 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 108.19 -1.964 . . . . 0.0 108.19 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.7 m -99.02 -161.21 0.86 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.306 . . . . 0.0 109.056 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -53.14 125.06 16.18 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 6' ' ' ALA . 96.2 mtt-85 56.46 86.82 0.06 Allowed 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 178.52 135.25 0.08 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.771 0.796 . . . . 0.0 109.955 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' SER . 40.7 t90 -50.54 143.57 9.06 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.603 0.716 . . . . 0.0 111.061 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.63 148.37 46.51 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -95.24 -32.04 13.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.918 -1.114 . . . . 0.0 109.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 78.4 mm-40 -154.65 177.92 10.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.354 -0.841 . . . . 0.0 108.885 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -60.35 -48.86 79.94 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.42 ' C ' ' H ' ' A' ' 14' ' ' CYS . 16.4 ttmm -76.47 -35.03 58.66 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.741 -0.6 . . . . 0.0 111.128 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.49 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 7.8 m-20 -59.87 -1.3 0.27 Allowed 'General case' 0 N--CA 1.482 1.14 0 O-C-N 121.004 -1.06 . . . . 0.0 110.618 -178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.692 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 47.9 t -90.58 147.68 23.18 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.021 -1.049 . . . . 0.0 108.753 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.513 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -58.1 139.83 53.94 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.217 -0.927 . . . . 0.0 109.677 -179.328 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 126.22 21.41 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.831 -0.747 . . . . 0.0 109.024 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.62 -6.78 24.33 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.692 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 86.0 m-85 -128.69 143.75 51.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.307 -1.114 . . . . 0.0 110.792 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.542 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 65.5 t30 -102.9 145.84 29.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.494 -0.754 . . . . 0.0 109.123 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.4 t -86.95 128.92 35.06 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.031 -1.043 . . . . 0.0 109.143 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 88.3 t -128.6 136.38 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.568 -0.707 . . . . 0.0 110.061 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -66.63 140.41 57.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.409 -0.807 . . . . 0.0 109.305 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.643 ' HB1' ' OD1' ' A' ' 26' ' ' ASN . . . -87.2 -142.58 0.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.519 -0.738 . . . . 0.0 110.27 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.518 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 8.9 p90 -172.22 -42.15 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.991 -0.683 . . . . 0.0 111.188 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.518 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -100.01 11.03 40.3 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.41 -1.432 . . . . 0.0 110.078 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.643 ' OD1' ' HB1' ' A' ' 23' ' ' ALA . 3.1 p-10 -140.42 2.41 1.85 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.448 -0.783 . . . . 0.0 109.127 178.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.3 mm-40 46.79 34.21 2.49 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.089 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 28' ' ' GLN . 19.1 mm-40 -122.57 -167.79 1.63 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.51 -0.744 . . . . 0.0 109.276 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.705 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.2 m -127.86 123.41 35.02 Favored 'General case' 0 C--O 1.181 -2.54 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 p -112.8 120.01 39.99 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.194 -0.941 . . . . 0.0 110.143 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -67.39 143.61 56.22 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.716 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -148.02 134.56 19.77 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.6 110.8 1.82 Allowed 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.401 ' HG2' ' H ' ' A' ' 34' ' ' LYS . 46.5 pttt . . . . . 0 C--N 1.305 -1.365 0 O-C-N 120.973 -1.08 . . . . 0.0 111.286 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.488 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 26.2 p . . . . . 0 N--CA 1.489 1.485 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.51 138.39 28.83 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 108.694 -1.762 . . . . 0.0 108.694 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.541 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 26.1 t -100.7 -138.63 0.33 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.281 -1.129 . . . . 0.0 108.701 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.541 ' N ' ' OG ' ' A' ' 3' ' ' SER . 12.7 tmtt? -61.39 128.43 36.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.675 -1.265 . . . . 0.0 107.745 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.682 ' N ' ' O ' ' A' ' 31' ' ' CYS . 45.0 ptt85 41.76 90.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 122.578 1.18 . . . . 0.0 108.92 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -169.59 139.15 2.0 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-O 122.039 0.923 . . . . 0.0 109.377 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.729 ' HE1' ' HZ2' ' A' ' 9' ' ' LYS . 0.6 OUTLIER -47.07 131.63 12.42 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.713 0.768 . . . . 0.0 112.217 -177.603 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.587 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -121.09 152.32 38.82 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 177.97 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.729 ' HZ2' ' HE1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -98.6 -28.37 13.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.897 -1.127 . . . . 0.0 109.058 178.618 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.648 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 24.5 mt-10 -145.33 179.2 7.55 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-O 121.761 0.791 . . . . 0.0 109.825 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -61.26 -47.61 85.23 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.443 -0.786 . . . . 0.0 109.003 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 14' ' ' CYS . 85.1 tttt -83.56 -22.35 32.38 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.397 -0.815 . . . . 0.0 109.898 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.648 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 14.7 t70 -47.33 -11.88 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.019 -1.05 . . . . 0.0 109.882 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.547 ' N ' ' O ' ' A' ' 12' ' ' LYS . 59.9 m -83.25 133.57 34.99 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.475 ' C ' ' O ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -42.07 145.99 0.32 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.358 -0.839 . . . . 0.0 109.378 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -49.67 125.42 11.51 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.557 -0.714 . . . . 0.0 109.209 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.01 0.25 41.6 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -129.84 141.95 50.75 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.609 -0.936 . . . . 0.0 109.501 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.699 ' ND2' ' O ' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -103.56 158.89 16.05 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.212 -0.93 . . . . 0.0 109.24 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 39.1 t -92.37 112.67 24.7 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.763 -1.211 . . . . 0.0 110.031 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.49 ' O ' ' CB ' ' A' ' 29' ' ' SER . 75.5 t -89.28 132.07 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -81.02 124.53 29.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.245 -0.91 . . . . 0.0 109.292 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.781 ' HB1' ' CE2' ' A' ' 25' ' ' TYR . . . -114.03 118.63 34.64 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.949 0.88 . . . . 0.0 110.55 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.584 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -54.29 -11.95 0.58 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.781 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 34.7 p90 -94.75 129.92 41.49 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.371 -1.456 . . . . 0.0 110.102 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.604 ' O ' ' C ' ' A' ' 27' ' ' GLN . 68.1 m-20 55.14 34.16 22.02 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.478 -0.764 . . . . 0.0 109.446 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.604 ' C ' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 29.44 43.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 122.261 1.029 . . . . 0.0 108.592 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.59 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 1.2 tm0? -111.36 163.62 13.79 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.667 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 14.6 m -125.8 148.33 49.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.185 -0.947 . . . . 0.0 110.473 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -108.44 117.21 33.57 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.63 -0.669 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.682 ' O ' ' N ' ' A' ' 5' ' ' ARG . 96.6 m -65.74 130.55 43.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.955 -1.091 . . . . 0.0 109.131 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.699 ' O ' ' ND2' ' A' ' 19' ' ' ASN . 95.5 mt-10 -146.98 135.09 21.54 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.966 -1.084 . . . . 0.0 110.639 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -74.92 107.45 7.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.402 -0.811 . . . . 0.0 110.183 178.739 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HG3' HD21 ' A' ' 19' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 O-C-N 120.563 -1.336 . . . . 0.0 111.461 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.547 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.4 p . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.01 141.15 35.53 Favored Glycine 0 N--CA 1.487 2.098 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.6 m -108.09 -152.96 0.49 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.378 -1.072 . . . . 0.0 109.207 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.07 118.83 4.35 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.098 -1.001 . . . . 0.0 108.588 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.543 ' HE ' ' CA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 53.96 91.55 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 122.087 0.946 . . . . 0.0 108.555 -178.798 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -175.77 125.7 0.22 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.844 0.83 . . . . 0.0 109.092 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.648 ' HA ' ' O ' ' A' ' 29' ' ' SER . 1.9 t90 -40.15 138.31 0.87 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.611 0.719 . . . . 0.0 110.856 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -111.57 140.28 46.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.831 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.6 tttm -86.71 -37.68 17.7 Favored 'General case' 0 C--N 1.294 -1.814 0 O-C-N 121.415 -0.803 . . . . 0.0 109.09 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.64 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 28.2 mt-10 -151.26 162.77 40.3 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.519 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -57.55 -32.64 67.31 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.104 -0.997 . . . . 0.0 108.611 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.421 ' HD2' ' HZ2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -87.5 -4.63 58.99 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.065 -1.022 . . . . 0.0 109.57 178.941 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.544 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -92.64 5.15 52.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.811 -1.181 . . . . 0.0 111.651 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.776 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 16.5 m -88.39 140.2 29.71 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.268 -1.52 . . . . 0.0 107.665 178.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 73.6 m -51.11 146.81 5.96 Favored 'General case' 0 N--CA 1.502 2.132 0 C-N-CA 117.078 -1.849 . . . . 0.0 110.407 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -52.01 118.63 3.59 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 121.195 -0.94 . . . . 0.0 110.259 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.05 -14.45 11.16 Favored Glycine 1 N--CA 1.534 5.167 0 C-N-CA 119.214 -1.47 . . . . 0.0 109.748 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -125.86 144.69 50.56 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.33 -1.1 . . . . 0.0 109.156 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.638 HD22 ' HG3' ' A' ' 34' ' ' LYS . 1.2 p30 -108.64 175.73 5.36 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.039 -1.038 . . . . 0.0 109.404 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.64 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 1.6 m -90.5 135.84 33.44 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.851 -1.156 . . . . 0.0 110.472 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.63 100.56 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -67.32 126.14 28.32 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.12 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -89.15 100.83 13.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.275 -0.89 . . . . 0.0 108.931 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.486 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -50.17 -27.65 6.19 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 108.869 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.456 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -99.41 149.5 23.12 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.955 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.645 ' ND2' ' O ' ' A' ' 26' ' ' ASN . 0.1 OUTLIER 51.29 12.47 0.14 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.968 -1.082 . . . . 0.0 108.852 -178.765 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.503 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 97.1 mm-40 43.94 -148.81 0.06 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.512 -0.742 . . . . 0.0 109.119 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 27' ' ' GLN . 98.6 mt-30 60.39 134.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.264 -0.897 . . . . 0.0 110.214 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.648 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 34.2 m -96.89 170.47 9.14 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.456 -0.778 . . . . 0.0 109.537 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -141.21 129.69 22.56 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.321 -0.862 . . . . 0.0 109.431 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 96.5 m -72.27 131.27 42.47 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.615 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.559 ' O ' ' ND2' ' A' ' 19' ' ' ASN . 1.0 OUTLIER -150.05 128.41 12.14 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.152 -0.968 . . . . 0.0 109.979 179.471 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.499 ' C ' ' CD ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.69 146.57 54.55 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.445 -0.784 . . . . 0.0 109.647 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.638 ' HG3' HD22 ' A' ' 19' ' ' ASN . 42.1 mttt . . . . . 0 N--CA 1.485 1.278 0 O-C-N 121.248 -0.908 . . . . 0.0 110.48 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.582 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.6 p . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 7' ' ' TRP . . . -63.02 120.12 20.01 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.562 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 10.9 t -96.69 -163.49 1.05 Allowed 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.181 -1.188 . . . . 0.0 108.744 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.562 ' N ' ' OG ' ' A' ' 3' ' ' SER . 15.7 tttp -45.47 121.59 3.09 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.187 -0.946 . . . . 0.0 108.604 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 56.66 86.89 0.06 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.15 152.43 1.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.337 -0.852 . . . . 0.0 110.865 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.64 ' HA ' ' O ' ' A' ' 29' ' ' SER . 20.2 t90 -53.7 154.19 3.95 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.905 0.859 . . . . 0.0 112.213 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.645 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -132.11 136.01 46.83 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -87.95 -46.94 8.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.589 -1.319 . . . . 0.0 107.547 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.783 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 95.7 mt-10 -141.38 178.41 7.45 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.466 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.1 tttt -58.38 -45.98 87.25 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.516 -0.874 . . . . 0.0 109.432 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' NZ ' ' CB ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.04 -34.33 71.17 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.198 -0.939 . . . . 0.0 110.44 179.351 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.602 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 3.4 t70 -52.91 -6.76 0.06 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.292 -0.88 . . . . 0.0 112.045 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.711 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 12.7 m -86.47 146.46 26.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 120.404 -1.435 . . . . 0.0 108.904 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.582 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 71.0 m -52.87 137.05 33.07 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -46.03 122.97 4.19 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.396 -0.815 . . . . 0.0 109.753 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.61 -8.07 24.15 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -125.52 142.52 51.46 Favored 'General case' 0 C--O 1.286 2.989 0 O-C-N 121.092 -1.24 . . . . 0.0 111.829 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -100.12 163.2 12.52 Favored 'General case' 0 N--CA 1.499 2.007 1 O-C-N 116.067 -4.145 . . . . 0.0 108.952 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.783 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 24.8 m -90.19 130.71 36.3 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 120.488 -1.382 . . . . 0.0 109.849 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 30' ' ' SER . 0.3 OUTLIER -133.84 159.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.589 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.438 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 57.2 t80 -102.99 127.47 50.21 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.187 -0.946 . . . . 0.0 110.137 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -93.49 113.0 25.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.161 -0.962 . . . . 0.0 109.257 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.1 p-90 -53.89 1.73 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.323 -0.861 . . . . 0.0 110.74 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.585 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 36.2 p90 -123.91 148.24 47.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.991 -1.068 . . . . 0.0 109.224 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 54.51 17.22 1.55 Allowed 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.894 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.516 ' C ' ' O ' ' A' ' 26' ' ' ASN . 53.7 mm-40 24.94 65.08 0.05 Allowed 'General case' 0 N--CA 1.5 2.048 0 CA-C-O 121.12 0.486 . . . . 0.0 111.459 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.568 ' HB3' HD21 ' A' ' 26' ' ' ASN . 13.8 tt0 -132.42 155.68 48.06 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.232 -0.917 . . . . 0.0 109.742 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.64 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.4 m -90.17 118.64 29.85 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.411 ' O ' HG12 ' A' ' 21' ' ' VAL . 27.3 t -103.98 124.24 48.65 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 120.963 -1.086 . . . . 0.0 111.184 -178.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 88.4 m -67.48 119.24 11.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.134 -0.978 . . . . 0.0 109.316 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.474 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 1.9 pt-20 -144.5 121.31 11.25 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -70.93 167.05 19.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.683 -1.261 . . . . 0.0 110.194 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.307 -1.26 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.528 ' HB2' ' CA ' ' A' ' 15' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -81.03 132.69 11.4 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.475 ' O ' ' C ' ' A' ' 4' ' ' LYS . 21.7 m -104.45 -162.45 0.89 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.357 -1.084 . . . . 0.0 108.675 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.475 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.9 OUTLIER -44.25 130.93 6.3 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.649 -1.282 . . . . 0.0 108.096 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 mtp85 54.37 82.51 0.09 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.989 -1.069 . . . . 0.0 108.713 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 125.62 0.24 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.996 -1.065 . . . . 0.0 110.514 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.542 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.1 t90 -49.07 131.32 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.419 0.628 . . . . 0.0 111.078 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.525 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -117.87 153.17 33.99 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 178.26 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.72 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 6.8 tmtt? -94.77 -25.19 16.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.03 . . . . 0.0 108.718 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.539 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 5.9 pt-20 -165.65 -171.82 2.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.408 -0.807 . . . . 0.0 109.277 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.42 -45.25 94.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.301 -0.874 . . . . 0.0 109.229 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.9 tptp -70.39 -25.26 63.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.327 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.72 ' CG ' ' H ' ' A' ' 9' ' ' LYS . 11.5 t70 -63.75 -17.62 63.22 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.274 -0.891 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.1 m -83.57 122.17 28.2 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 119.943 -1.723 . . . . 0.0 107.961 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.537 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.99 -173.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 122.132 0.967 . . . . 0.0 111.418 -177.81 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.537 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.5 OUTLIER 22.08 -143.23 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.722 177.281 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -89.45 29.94 5.92 Favored Glycine 0 C--N 1.284 -2.348 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.602 ' CD1' ' HB2' ' A' ' 33' ' ' ARG . 91.4 m-85 -82.83 135.41 34.96 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.534 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 17.3 p-10 -99.07 149.0 23.46 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.951 -1.093 . . . . 0.0 109.391 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 15.2 t -90.89 126.27 36.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.148 -0.97 . . . . 0.0 110.152 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 66.7 t -120.25 130.95 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.486 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 14.5 t80 -78.12 122.41 25.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.906 -1.121 . . . . 0.0 109.025 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' TYR . . . -98.38 88.66 4.2 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -7.67 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.099 -1.001 . . . . 0.0 109.469 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.4 m-85 -58.47 -46.69 86.1 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.082 -1.011 . . . . 0.0 109.864 -179.464 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.433 ' O ' ' C ' ' A' ' 27' ' ' GLN . 9.4 p-10 -147.98 45.63 1.08 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.05 -1.031 . . . . 0.0 109.797 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.486 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 96.6 mm-40 44.12 42.84 5.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.225 -0.922 . . . . 0.0 109.025 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -120.93 138.42 54.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.737 -0.602 . . . . 0.0 109.691 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.542 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 0.7 OUTLIER -95.62 112.95 24.56 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.293 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.0 t -98.52 114.98 27.59 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.042 -1.036 . . . . 0.0 110.831 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 18' ' ' TYR . 89.0 m -67.89 145.22 54.8 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.262 -0.898 . . . . 0.0 109.183 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.534 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 97.8 mt-10 -146.46 107.45 4.16 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.987 -1.071 . . . . 0.0 112.077 -178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.602 ' HB2' ' CD1' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -79.14 131.84 36.35 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.613 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt . . . . . 0 C--N 1.297 -1.69 0 O-C-N 120.699 -1.25 . . . . 0.0 108.44 178.916 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.786 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 11.0 p . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.068 0.461 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.56 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -66.14 -51.07 47.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.542 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 2.6 t 86.33 -169.2 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.471 0.653 . . . . 0.0 110.298 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 24.4 tttm -52.36 128.63 26.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.345 -0.847 . . . . 0.0 109.366 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttm-85 49.18 84.2 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.56 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.12 139.53 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.809 -0.757 . . . . 0.0 110.46 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.877 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.3 t90 -43.69 127.02 4.84 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.511 0.672 . . . . 0.0 110.878 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.54 ' O ' ' HB2' ' A' ' 29' ' ' SER . 22.0 p -123.98 133.61 53.65 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -91.82 -44.73 8.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.405 -1.434 . . . . 0.0 109.139 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.441 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 18.6 mt-10 -149.72 178.45 8.86 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -61.03 -47.61 85.64 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.59 -0.694 . . . . 0.0 109.989 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.26 -38.16 78.27 Favored 'General case' 0 C--N 1.292 -1.926 0 O-C-N 120.307 -1.495 . . . . 0.0 112.564 178.764 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.441 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 97.2 m-20 -66.98 -10.83 53.78 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.144 -0.972 . . . . 0.0 109.888 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.522 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 22.9 t -91.97 150.95 20.73 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.825 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.786 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.7 OUTLIER -61.89 135.88 57.75 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.38 143.25 6.68 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.761 -1.212 . . . . 0.0 109.039 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.19 -3.64 69.85 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.522 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 48.2 m-85 -125.92 141.28 52.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.297 -1.12 . . . . 0.0 111.284 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.53 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 12.5 p-10 -98.42 144.12 28.13 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 t -88.43 136.31 33.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.555 -0.716 . . . . 0.0 109.691 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.426 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 72.4 t -123.13 131.27 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -102.8 122.64 44.91 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.114 -0.991 . . . . 0.0 108.351 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB1' ' CE1' ' A' ' 25' ' ' TYR . . . -89.34 115.3 26.7 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.752 -1.218 . . . . 0.0 109.498 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.406 ' CD1' ' CD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -50.49 -27.19 6.12 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.623 -0.673 . . . . 0.0 110.06 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.806 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 2.1 p90 -99.23 164.5 12.11 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.003 -1.061 . . . . 0.0 110.175 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.806 ' OD1' ' O ' ' A' ' 25' ' ' TYR . 6.9 p-10 45.78 13.6 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 CA-C-O 121.143 0.497 . . . . 0.0 110.339 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 25' ' ' TYR . 95.3 mm-40 34.0 46.3 0.14 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.616 -0.677 . . . . 0.0 111.04 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.412 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 1.9 tp60 -120.23 127.07 52.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.256 -0.903 . . . . 0.0 109.29 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.877 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.5 m -101.42 150.86 22.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.552 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 27.7 t -149.32 129.43 13.58 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.626 -1.296 . . . . 0.0 111.091 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.5 OUTLIER -73.22 159.95 32.67 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.289 -0.882 . . . . 0.0 111.453 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -146.09 159.03 43.85 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.323 -0.86 . . . . 0.0 110.142 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.583 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -60.76 132.48 54.02 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.699 0.761 . . . . 0.0 111.878 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 5.8 mmmt . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 120.919 0.39 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.614 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -52.98 122.6 21.23 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 108.926 -1.67 . . . . 0.0 108.926 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 14.7 t -102.23 -166.36 1.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -1.119 . . . . 0.0 109.466 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.499 ' N ' ' OG ' ' A' ' 3' ' ' SER . 0.5 OUTLIER -39.86 116.52 0.65 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.956 -1.09 . . . . 0.0 109.243 -179.406 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 5' ' ' ARG . 9.6 ttm180 59.97 86.32 0.1 Allowed 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.656 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.61 137.18 0.2 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.104 -0.997 . . . . 0.0 110.436 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.751 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.4 t90 -45.97 136.44 6.54 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.479 0.657 . . . . 0.0 111.94 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.993 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 2.4 p -134.11 152.29 51.77 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.655 -0.653 . . . . 0.0 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.449 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 11.7 mtmt -93.03 -49.26 6.1 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.769 -1.207 . . . . 0.0 108.289 178.306 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.616 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 34.2 mp0 -138.27 178.7 6.93 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.479 ' HB2' ' HZ2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -60.9 -43.58 98.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.793 -1.192 . . . . 0.0 108.187 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -65.89 -23.09 66.57 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.673 -0.642 . . . . 0.0 109.556 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.616 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 35.0 t70 -67.59 -16.09 63.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.157 -0.965 . . . . 0.0 110.701 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 83.5 m -84.81 127.33 34.08 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 120.789 -1.194 . . . . 0.0 108.128 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.568 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -57.69 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.774 0.797 . . . . 0.0 110.906 -178.452 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 13.0 t 19.6 -139.73 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 122.411 1.1 . . . . 0.0 111.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.532 ' N ' ' SG ' ' A' ' 16' ' ' CYS . . . -97.66 33.34 5.95 Favored Glycine 0 C--N 1.287 -2.177 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.467 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 78.3 m-85 -89.61 142.77 27.37 Favored 'General case' 0 C--N 1.288 -2.077 0 O-C-N 121.792 -0.828 . . . . 0.0 109.67 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -101.49 153.64 19.53 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.394 -0.816 . . . . 0.0 110.446 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.0 t -89.8 139.07 30.94 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.242 -0.911 . . . . 0.0 109.153 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -128.61 163.99 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.417 -0.802 . . . . 0.0 109.064 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.522 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 74.9 t80 -113.85 132.15 56.0 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.274 -0.891 . . . . 0.0 110.544 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -109.55 132.64 53.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.74 . . . . 0.0 110.02 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.424 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -56.9 -46.34 82.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.6 -0.688 . . . . 0.0 111.407 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.424 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -72.92 140.58 47.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.726 -1.233 . . . . 0.0 110.329 -178.226 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.658 ' O ' ' C ' ' A' ' 27' ' ' GLN . 18.9 m120 56.82 25.41 10.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.759 -0.588 . . . . 0.0 110.235 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.658 ' C ' ' O ' ' A' ' 26' ' ' ASN . 50.6 mm-40 21.78 49.25 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.607 ' N ' ' O ' ' A' ' 26' ' ' ASN . 8.8 tt0 -115.57 141.68 47.74 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.393 -0.817 . . . . 0.0 110.248 -178.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.751 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.0 m -92.7 142.85 26.9 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -129.58 133.22 47.06 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.267 -0.896 . . . . 0.0 110.858 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.993 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 99.2 m -70.77 144.07 50.99 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.43 -0.794 . . . . 0.0 110.808 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -151.31 135.52 16.76 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 4.2 tmm_? -58.77 143.55 46.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.22 -0.925 . . . . 0.0 110.285 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.505 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 O-C-N 121.511 -0.743 . . . . 0.0 110.025 178.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.734 ' HA ' ' O ' ' A' ' 13' ' ' ASP . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.394 0.616 . . . . 0.0 109.969 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.2 150.77 51.99 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 108.336 -1.906 . . . . 0.0 108.336 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . 8.1 t -95.41 -178.07 4.31 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.136 -1.214 . . . . 0.0 108.921 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.728 ' NZ ' HH21 ' A' ' 33' ' ' ARG . 31.7 tttp -47.76 120.84 3.62 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.553 ' HE ' HH22 ' A' ' 33' ' ' ARG . 9.5 mmt85 58.77 86.21 0.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.502 ' O ' ' N ' ' A' ' 31' ' ' CYS . . . -177.5 147.1 0.49 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.281 -0.887 . . . . 0.0 110.757 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.913 ' HA ' ' O ' ' A' ' 29' ' ' SER . 58.9 t90 -39.2 135.4 0.99 Allowed 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.944 0.878 . . . . 0.0 112.165 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.959 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 17.9 p -132.02 157.98 42.71 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.26 -42.54 8.49 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.727 -1.233 . . . . 0.0 108.896 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 2.5 pt-20 -158.21 -170.23 3.05 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -61.52 -43.31 99.09 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.604 -0.685 . . . . 0.0 111.602 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -85.84 -19.43 30.65 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.683 -1.261 . . . . 0.0 112.09 -177.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.734 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 1.1 m-20 -73.15 -0.53 14.42 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 120.507 -1.371 . . . . 0.0 110.793 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 20.6 m -90.58 144.29 25.91 Favored 'General case' 0 C--N 1.308 -1.205 0 O-C-N 120.492 -1.38 . . . . 0.0 109.221 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.564 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.06 125.1 19.06 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.382 -0.823 . . . . 0.0 109.494 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.564 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -28.15 130.3 0.06 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.257 0.551 . . . . 0.0 109.975 -179.672 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 103.02 -13.54 55.96 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -125.85 146.89 49.62 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.09 -1.241 . . . . 0.0 110.68 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.742 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 3.4 t30 -97.57 -166.86 1.44 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.8 t -138.12 130.54 29.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.424 -0.797 . . . . 0.0 109.044 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.3 t -139.38 154.95 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.367 -0.833 . . . . 0.0 110.137 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -75.39 126.36 30.86 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.516 -0.74 . . . . 0.0 109.618 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -105.08 109.68 21.77 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.286 -0.884 . . . . 0.0 110.574 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.468 ' C ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p90 -57.39 -9.5 1.07 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.285 -0.884 . . . . 0.0 111.238 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.437 ' HB3' ' ND2' ' A' ' 26' ' ' ASN . 15.4 t80 -59.78 -47.97 83.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.744 -1.223 . . . . 0.0 110.231 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.57 ' N ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -146.46 51.86 1.12 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.548 -1.345 . . . . 0.0 109.168 178.324 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 26' ' ' ASN . 7.0 mm100 40.94 31.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.543 -0.723 . . . . 0.0 109.329 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.562 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -119.16 149.75 41.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -179.829 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.913 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.1 m -89.03 160.19 17.21 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.173 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 8.6 t -139.25 134.76 33.1 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.961 -1.087 . . . . 0.0 110.659 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.959 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 94.6 m -70.4 133.94 47.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.163 -0.961 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -150.22 144.45 25.63 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.807 -1.183 . . . . 0.0 110.353 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.728 HH21 ' NZ ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -56.52 163.21 1.85 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.483 -0.761 . . . . 0.0 110.444 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.308 -1.238 0 O-C-N 120.796 -1.19 . . . . 0.0 110.594 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.3 p . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.521 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -75.65 131.76 12.39 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 108.685 -1.766 . . . . 0.0 108.685 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 91.9 p -103.57 -145.23 0.37 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -1.081 . . . . 0.0 109.471 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -51.65 120.55 5.31 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.051 -1.031 . . . . 0.0 109.001 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.41 88.16 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.232 -0.918 . . . . 0.0 108.625 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 134.75 0.31 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.717 0.77 . . . . 0.0 109.939 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.88 ' HA ' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -44.74 148.79 0.48 Allowed 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.984 0.897 . . . . 0.0 111.929 -179.099 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.684 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -125.34 153.59 43.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.068 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 87.1 tttt -85.56 -33.69 21.66 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 7.3 mm-40 -164.54 -173.04 2.89 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-O 121.492 0.663 . . . . 0.0 109.632 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -62.79 -48.67 78.13 Favored 'General case' 0 C--O 1.184 -2.351 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.57 ' HZ2' ' CB ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -87.17 2.75 48.96 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 118.471 -1.292 . . . . 0.0 109.528 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.569 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 49.0 m-20 -93.29 4.24 54.31 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.678 -0.639 . . . . 0.0 111.97 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.684 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 1.3 m -84.57 155.94 21.85 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 120.297 -1.502 . . . . 0.0 107.167 179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 2' ' ' GLY . 89.0 m -47.2 166.75 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.916 -1.115 . . . . 0.0 109.215 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.61 130.45 44.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.198 -0.939 . . . . 0.0 110.106 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.77 8.04 85.0 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 32' ' ' GLU . 61.4 m-85 -119.3 148.03 43.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.101 -1.235 . . . . 0.0 110.888 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.2 t30 -118.71 157.23 27.87 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.445 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 16.0 t -91.22 132.47 36.09 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.934 -1.103 . . . . 0.0 110.739 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -121.33 131.79 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.62 126.1 26.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.123 -0.985 . . . . 0.0 108.907 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -112.74 108.87 18.05 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.432 -0.793 . . . . 0.0 109.513 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.52 ' CG ' ' N ' ' A' ' 25' ' ' TYR . 5.9 p-90 -53.92 -39.16 65.6 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.102 -0.998 . . . . 0.0 109.324 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' N ' ' CG ' ' A' ' 24' ' ' TRP . 11.5 p90 -71.5 141.57 50.16 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.327 -0.949 . . . . 0.0 108.904 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.456 ' OD1' ' OE1' ' A' ' 28' ' ' GLN . 1.0 OUTLIER 70.22 -4.68 1.49 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.331 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.433 ' H ' ' C ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER 57.62 16.93 3.68 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.777 -0.824 . . . . 0.0 108.777 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.555 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 98.6 mt-30 -113.59 -172.06 2.01 Favored 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.548 -1.345 . . . . 0.0 108.55 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.88 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 50.1 m -121.01 138.43 54.17 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -103.31 139.8 38.26 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 121.424 -0.798 . . . . 0.0 111.234 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 87.9 m -70.92 152.0 44.11 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.377 -0.827 . . . . 0.0 109.653 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -147.57 -156.82 0.75 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.555 ' N ' ' OE1' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -156.85 126.73 6.3 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 122.316 1.055 . . . . 0.0 108.793 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt . . . . . 0 C--N 1.306 -1.293 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -178.361 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.479 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.442 0.639 . . . . 0.0 109.78 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.489 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -68.43 -51.23 32.9 Favored Glycine 0 N--CA 1.495 2.594 0 O-C-N 121.382 -0.824 . . . . 0.0 113.436 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.544 ' O ' ' C ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER 80.61 172.62 0.13 Allowed 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.075 -1.25 . . . . 0.0 110.244 -178.203 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.986 ' NZ ' ' HE ' ' A' ' 33' ' ' ARG . 46.4 tttp -28.77 129.56 0.07 Allowed 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.15 -0.969 . . . . 0.0 110.426 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 49.19 78.76 0.09 Allowed 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 3' ' ' SER . . . -171.39 135.87 0.97 Allowed 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.324 -1.35 . . . . 0.0 111.138 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.644 ' HA ' ' O ' ' A' ' 29' ' ' SER . 23.3 t90 -51.43 136.42 25.64 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.651 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.586 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -123.22 147.85 46.46 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 178.948 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.58 ' HB3' ' OD2' ' A' ' 13' ' ' ASP . 16.0 ttpt -88.94 -46.96 8.49 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.915 -1.115 . . . . 0.0 108.486 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.425 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 1.5 mm-40 -142.93 -179.36 6.31 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.483 ' CE ' ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -61.61 -36.05 79.6 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.678 -1.264 . . . . 0.0 110.181 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -80.72 -8.55 59.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.031 -1.043 . . . . 0.0 109.993 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.58 ' OD2' ' HB3' ' A' ' 9' ' ' LYS . 24.3 t0 -85.01 0.22 52.18 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.813 -1.179 . . . . 0.0 110.894 -179.3 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 5.3 m -88.64 142.87 27.33 Favored 'General case' 0 C--N 1.309 -1.193 0 O-C-N 120.121 -1.612 . . . . 0.0 108.028 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 3' ' ' SER . 34.6 m -47.87 140.57 6.53 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.342 -0.849 . . . . 0.0 108.888 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.56 137.13 15.74 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.112 -0.993 . . . . 0.0 109.716 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.44 -0.73 78.18 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -124.83 144.95 50.02 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.29 -1.124 . . . . 0.0 110.063 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.519 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 t30 -100.24 153.61 19.13 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.473 -0.767 . . . . 0.0 110.127 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 41.9 t -91.15 114.58 27.15 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.537 0.684 . . . . 0.0 109.245 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -97.06 142.84 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.605 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -103.12 127.13 50.51 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.191 -0.943 . . . . 0.0 109.533 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.14 100.94 13.46 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.203 -0.936 . . . . 0.0 109.36 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.502 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 1.0 OUTLIER -44.14 -27.35 0.39 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.411 -0.806 . . . . 0.0 110.099 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' C ' ' H ' ' A' ' 27' ' ' GLN . 5.9 p90 -98.71 146.34 25.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.957 -1.089 . . . . 0.0 108.16 179.21 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 27' ' ' GLN . 1.1 m120 61.03 -3.43 0.16 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.359 -0.838 . . . . 0.0 109.348 -179.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.52 ' H ' ' C ' ' A' ' 25' ' ' TYR . 3.2 mp0 45.46 50.99 9.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.177 -0.952 . . . . 0.0 109.025 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -115.79 132.88 56.51 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.644 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 13.8 m -96.11 124.39 40.1 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.989 -1.069 . . . . 0.0 110.926 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.432 ' H ' HG12 ' A' ' 21' ' ' VAL . 1.2 p -105.5 118.67 37.15 Favored 'General case' 0 C--N 1.31 -1.147 0 O-C-N 121.273 -0.892 . . . . 0.0 109.792 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.7 m -65.72 142.87 57.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.741 -1.224 . . . . 0.0 108.923 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -142.49 139.71 31.61 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.982 -1.074 . . . . 0.0 110.548 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.986 ' HE ' ' NZ ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -63.97 60.31 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.858 -0.526 . . . . 0.0 112.152 179.779 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.414 ' N ' ' O ' ' A' ' 32' ' ' GLU . 1.1 mmmp? . . . . . 0 N--CA 1.492 1.658 0 O-C-N 120.236 -1.54 . . . . 0.0 110.627 179.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.673 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.615 ' O ' ' HB3' ' A' ' 3' ' ' SER . . . -69.04 -59.19 6.06 Favored Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.925 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 2' ' ' GLY . 33.6 t 84.74 -165.28 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.785 -0.832 . . . . 0.0 110.549 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 68.6 tttt -51.64 132.2 30.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.626 -0.671 . . . . 0.0 109.318 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 53.37 78.6 0.14 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HB1' ' CA ' ' A' ' 2' ' ' GLY . . . -178.09 129.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.985 -1.072 . . . . 0.0 110.78 -178.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.491 ' HA ' ' O ' ' A' ' 29' ' ' SER . 38.4 t90 -52.78 117.52 2.99 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.511 -0.743 . . . . 0.0 110.219 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.648 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -109.32 150.66 27.68 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.731 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -92.5 -35.02 13.84 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.511 -1.368 . . . . 0.0 109.423 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.648 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -159.22 -170.16 2.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 109.029 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.7 tptm -60.64 -48.52 81.4 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.903 -1.123 . . . . 0.0 109.43 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -69.84 -41.99 74.19 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.542 -0.724 . . . . 0.0 111.678 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HB3' ' H ' ' A' ' 10' ' ' GLU . 14.4 t70 -54.29 -14.78 1.28 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.796 -1.19 . . . . 0.0 110.429 -178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.659 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 48.5 t -88.95 146.12 25.1 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.029 -1.044 . . . . 0.0 108.851 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.673 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.6 m -54.53 134.82 46.51 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.213 -178.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 123.96 16.23 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.25 -7.22 10.67 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.715 -1.754 . . . . 0.0 108.715 -179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.659 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 97.5 m-85 -125.38 150.98 46.73 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -1.067 . . . . 0.0 110.807 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.65 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 9.3 p-10 -96.57 133.1 41.48 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.0 t -93.4 125.93 38.26 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.354 -0.841 . . . . 0.0 109.763 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 21' ' ' VAL . 3.2 p -119.54 114.12 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -81.33 112.73 18.9 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.581 ' HB3' ' OD1' ' A' ' 26' ' ' ASN . . . -84.43 89.95 7.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.021 -1.049 . . . . 0.0 109.641 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.687 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -47.11 -22.1 0.32 Allowed 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.814 -0.554 . . . . 0.0 110.903 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.575 ' CD1' ' HB1' ' A' ' 23' ' ' ALA . 4.2 p90 -77.88 -45.18 24.96 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.516 -1.365 . . . . 0.0 111.267 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 23' ' ' ALA . 53.2 p30 -103.64 9.2 37.43 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.366 -1.458 . . . . 0.0 109.721 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 57.3 15.07 2.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.607 -0.683 . . . . 0.0 111.245 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -119.07 138.66 52.72 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 120.961 -1.087 . . . . 0.0 109.909 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.491 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 4.3 m -96.2 131.16 42.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.032 -1.042 . . . . 0.0 109.612 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.3 t -117.43 104.15 10.82 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 121.439 -0.788 . . . . 0.0 109.957 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -64.59 153.92 37.83 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.833 -1.167 . . . . 0.0 110.056 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.65 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 94.6 mt-10 -144.12 137.3 27.4 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.363 -0.835 . . . . 0.0 110.177 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.626 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -73.13 85.35 1.35 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt . . . . . 0 N--CA 1.488 1.467 0 O-C-N 119.97 -1.707 . . . . 0.0 108.959 178.453 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.513 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 24.7 p . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.58 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -79.36 132.2 11.25 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.319 -1.419 . . . . 0.0 109.673 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.563 ' O ' ' HB2' ' A' ' 31' ' ' CYS . 6.7 p -111.37 -158.62 0.65 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.417 -1.049 . . . . 0.0 108.905 179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' A' ' 3' ' ' SER . 14.1 tttt -37.33 119.83 0.73 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.104 -0.998 . . . . 0.0 109.423 -179.432 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.411 ' N ' ' OE2' ' A' ' 32' ' ' GLU . 21.1 mtt180 50.74 87.55 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.463 ' HB3' ' N ' ' A' ' 3' ' ' SER . . . -172.23 131.52 0.62 Allowed 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.764 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.4 t90 -44.51 135.73 4.61 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.118 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.6 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -129.98 148.7 51.86 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -95.34 -43.46 8.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.791 -1.193 . . . . 0.0 109.492 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.72 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 14.8 mt-10 -135.67 164.46 27.81 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.317 -0.864 . . . . 0.0 109.076 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.4 ttpt -55.59 -30.58 61.1 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.067 -1.021 . . . . 0.0 109.176 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.04 -8.33 51.76 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.992 -1.067 . . . . 0.0 109.436 179.191 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.632 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 10.7 t70 -78.73 -3.6 45.07 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.89 -1.131 . . . . 0.0 110.152 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 7.5 m -85.78 141.29 29.78 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 120.623 -1.298 . . . . 0.0 107.958 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 62.3 m -49.03 144.76 4.52 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.165 -0.959 . . . . 0.0 109.702 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.19 136.45 15.21 Favored 'General case' 0 C--O 1.166 -3.309 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 95.82 -1.29 63.36 Favored Glycine 0 N--CA 1.491 2.36 0 C-N-CA 117.397 -2.335 . . . . 0.0 109.663 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -137.76 145.34 42.32 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.078 -1.248 . . . . 0.0 109.682 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.648 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.0 p-10 -103.21 176.43 5.15 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.549 1.166 . . . . 0.0 108.133 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 23.4 m -98.45 128.6 44.88 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 119.999 -1.688 . . . . 0.0 109.983 177.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' ' 30' ' ' SER . 2.2 t -122.16 120.39 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.529 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 9.3 t80 -78.28 120.3 22.85 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.321 -0.862 . . . . 0.0 109.105 -178.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -97.35 108.82 21.63 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.823 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 6.0 p90 -56.26 121.61 9.91 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.128 -0.983 . . . . 0.0 109.57 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.823 ' HB2' ' O ' ' A' ' 24' ' ' TRP . 2.5 t80 157.81 -79.56 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.053 -1.029 . . . . 0.0 109.203 178.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -110.21 22.68 15.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.437 -0.789 . . . . 0.0 109.742 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.529 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 52.0 mm-40 54.9 47.32 22.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.255 -0.903 . . . . 0.0 108.721 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -115.93 131.79 56.84 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.694 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 63.6 m -94.52 122.65 37.32 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.988 -1.07 . . . . 0.0 109.838 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.46 ' O ' ' HB ' ' A' ' 21' ' ' VAL . 30.6 p -97.12 113.99 25.62 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.021 -1.049 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.648 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.6 m -64.52 134.18 53.92 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.826 -1.172 . . . . 0.0 109.464 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.504 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 69.8 mm-40 -142.35 141.81 32.38 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.375 -0.828 . . . . 0.0 110.715 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.755 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.53 43.46 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.023 -1.048 . . . . 0.0 111.012 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 32' ' ' GLU . 12.3 mmtm . . . . . 0 C--N 1.292 -1.909 0 O-C-N 120.236 -1.54 . . . . 0.0 110.049 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.524 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 14.7 p . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.11 0.481 . . . . 0.0 110.06 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.491 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -77.42 132.56 12.15 Favored Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.307 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.678 ' O ' ' C ' ' A' ' 4' ' ' LYS . 83.2 p -120.94 148.1 44.54 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.306 -1.114 . . . . 0.0 108.598 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.678 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER 4.77 113.27 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.454 0.645 . . . . 0.0 110.647 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.664 HH11 ' HB3' ' A' ' 5' ' ' ARG . 0.2 OUTLIER 60.22 87.15 0.09 Allowed 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 176.36 133.87 0.05 Allowed 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 110.114 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.781 ' HA ' ' O ' ' A' ' 29' ' ' SER . 24.3 t90 -51.44 130.05 26.58 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.505 0.669 . . . . 0.0 111.282 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.823 ' O ' ' HB2' ' A' ' 29' ' ' SER . 25.3 p -116.26 148.73 40.18 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -92.29 -46.19 7.83 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.408 -1.433 . . . . 0.0 109.123 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.526 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 1.3 mt-10 -154.11 -178.07 6.85 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -60.45 -43.53 96.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.596 -1.315 . . . . 0.0 109.755 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -71.53 -9.76 58.71 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.764 -1.21 . . . . 0.0 110.876 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.526 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.6 OUTLIER -99.46 8.71 44.33 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.921 -1.112 . . . . 0.0 110.078 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.621 ' SG ' ' CB ' ' A' ' 18' ' ' TYR . 16.3 t -101.25 135.11 43.27 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.43 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 0.0 OUTLIER -56.83 145.2 30.3 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.938 -1.101 . . . . 0.0 109.982 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.0 m -49.48 138.14 13.95 Favored 'General case' 1 C--O 1.152 -4.036 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.22 2.08 68.83 Favored Glycine 0 C--N 1.304 -1.243 0 N-CA-C 108.654 -1.778 . . . . 0.0 108.654 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.621 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 90.5 m-85 -137.11 149.39 47.3 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.503 -0.998 . . . . 0.0 110.545 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.897 HD22 ' HB2' ' A' ' 32' ' ' GLU . 1.8 p30 -108.64 163.16 13.49 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.482 -0.762 . . . . 0.0 109.528 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 t -106.21 134.15 49.8 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.228 -0.92 . . . . 0.0 110.033 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 30' ' ' SER . 7.1 p -138.82 141.46 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.145 -0.972 . . . . 0.0 109.701 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -84.41 127.18 33.86 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.061 -1.024 . . . . 0.0 110.508 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -95.6 95.06 8.11 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.442 -0.787 . . . . 0.0 109.434 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.514 ' O ' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -53.49 -40.55 65.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.415 -0.803 . . . . 0.0 110.766 -179.393 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.405 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 51.4 p90 -63.01 -46.37 87.97 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.604 -1.31 . . . . 0.0 110.488 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.462 ' C ' ' H ' ' A' ' 28' ' ' GLN . 12.7 m-20 -92.88 1.53 57.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.86 -1.15 . . . . 0.0 109.23 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 24' ' ' TRP . 99.4 mm-40 56.53 6.3 0.27 Allowed 'General case' 0 C--O 1.158 -3.754 0 CA-C-O 123.998 1.856 . . . . 0.0 111.771 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.745 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 30.1 mt-30 -117.89 154.89 31.11 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 113.623 -1.626 . . . . 0.0 107.875 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.823 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.8 m -91.07 159.54 16.07 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 120.95 -1.094 . . . . 0.0 110.175 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.686 ' O ' HG12 ' A' ' 21' ' ' VAL . 33.2 t -143.03 134.81 26.7 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 121.097 -1.002 . . . . 0.0 110.456 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.649 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 3.4 m -68.89 148.71 49.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.396 -0.815 . . . . 0.0 109.573 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.897 ' HB2' HD22 ' A' ' 19' ' ' ASN . 44.4 mm-40 -141.63 145.65 35.26 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.845 -1.159 . . . . 0.0 111.676 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.65 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -69.76 92.52 0.68 Allowed 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.09 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG3' ' ND2' ' A' ' 19' ' ' ASN . 56.9 mttp . . . . . 0 C--N 1.304 -1.382 0 O-C-N 120.289 -1.507 . . . . 0.0 108.604 178.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 3' ' ' SER . 19.4 p . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 121.231 0.538 . . . . 0.0 109.83 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.498 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -53.86 89.11 0.01 OUTLIER Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.607 ' O ' ' O ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -110.95 104.0 12.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.246 -1.149 . . . . 0.0 109.479 -179.081 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.607 ' O ' ' O ' ' A' ' 3' ' ' SER . 33.5 tttt 49.39 108.96 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.925 0.869 . . . . 0.0 109.205 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.595 ' HG3' ' HG2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 50.78 83.39 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.263 -0.898 . . . . 0.0 108.61 -178.84 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.93 120.54 0.06 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.777 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.8 t90 -48.95 142.35 6.65 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.491 -0.756 . . . . 0.0 111.482 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.462 ' N ' ' CD1' ' A' ' 7' ' ' TRP . 3.0 p -125.64 148.72 48.89 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.464 ' HB3' ' CB ' ' A' ' 13' ' ' ASP . 81.1 tttt -86.01 -28.18 24.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.093 -1.005 . . . . 0.0 108.832 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.776 ' HG3' ' H ' ' A' ' 11' ' ' LYS . 19.2 tp10 -170.28 -157.35 0.15 Allowed 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.776 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 6.3 tmtt? -69.39 -49.03 59.18 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.356 0.598 . . . . 0.0 109.659 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.7 tttm -69.29 -45.56 69.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.441 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.549 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 9.9 t70 -53.83 -9.05 0.2 Allowed 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.463 -0.773 . . . . 0.0 110.535 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.74 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -94.19 150.54 20.22 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.914 -1.116 . . . . 0.0 108.342 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.731 ' O ' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER -60.54 133.77 56.42 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.24 -0.913 . . . . 0.0 110.955 -178.379 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -48.78 66.46 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 CA-C-O 121.533 0.682 . . . . 0.0 110.954 179.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.731 ' N ' ' O ' ' A' ' 15' ' ' CYS . . . 179.05 -29.17 0.06 OUTLIER Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.206 -1.958 . . . . 0.0 108.206 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.74 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 94.1 m-85 -108.29 153.75 22.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.707 -0.878 . . . . 0.0 110.19 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.712 ' C ' ' SG ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -101.83 134.09 45.55 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.55 -0.719 . . . . 0.0 109.263 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 43.7 t -80.52 121.51 25.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.985 -1.072 . . . . 0.0 109.938 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.685 HG23 ' OD1' ' A' ' 19' ' ' ASN . 41.4 t -126.55 132.56 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.503 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 62.2 t80 -70.97 131.31 43.5 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.399 178.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.987 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -86.18 81.5 8.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 120.988 -1.07 . . . . 0.0 108.956 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.564 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -54.34 -36.83 64.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.272 -0.892 . . . . 0.0 111.123 -178.934 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.634 ' CE2' ' OD1' ' A' ' 26' ' ' ASN . 51.0 p90 -71.93 -27.08 62.57 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.648 -1.282 . . . . 0.0 110.997 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.861 ' OD1' ' HB1' ' A' ' 23' ' ' ALA . 12.1 p-10 -133.56 13.13 4.11 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.776 -1.202 . . . . 0.0 109.121 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.987 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 79.4 mm-40 63.93 -163.41 0.26 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.436 0.636 . . . . 0.0 110.724 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 59.93 -174.5 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.318 -0.864 . . . . 0.0 109.487 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.777 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 3.2 m -132.67 121.77 23.64 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.235 -0.916 . . . . 0.0 108.856 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -114.62 113.28 24.16 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.218 -0.926 . . . . 0.0 109.966 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.712 ' SG ' ' C ' ' A' ' 19' ' ' ASN . 0.7 OUTLIER -67.01 146.51 54.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.419 -0.913 . . . . 0.0 110.299 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 6.9 pt-20 -142.06 152.31 43.21 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.292 -0.88 . . . . 0.0 109.441 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -50.59 153.08 1.75 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.854 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HB2' ' HB3' ' A' ' 19' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.306 -1.295 0 O-C-N 120.779 -1.201 . . . . 0.0 109.611 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 15.8 p . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.558 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -76.19 149.84 38.03 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 119.517 -1.325 . . . . 0.0 110.422 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.71 ' O ' ' N ' ' A' ' 5' ' ' ARG . 3.9 m -110.13 -162.57 0.81 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.275 -1.133 . . . . 0.0 109.861 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.779 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 3.6 tttm -58.53 54.23 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.5 -0.75 . . . . 0.0 110.327 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.71 ' N ' ' O ' ' A' ' 3' ' ' SER . 33.7 ptt-85 137.55 76.59 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.662 0.744 . . . . 0.0 109.144 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.416 ' HB3' ' H ' ' A' ' 3' ' ' SER . . . -175.0 146.77 0.89 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.187 -0.946 . . . . 0.0 110.512 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.75 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.1 t90 -47.83 151.11 0.95 Allowed 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.185 0.993 . . . . 0.0 111.746 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER -121.98 153.58 38.35 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.047 -179.597 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -110.8 -29.51 7.94 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.992 -1.067 . . . . 0.0 109.057 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.579 ' HG2' ' H ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -168.79 -173.23 1.8 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.336 -0.852 . . . . 0.0 109.28 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.579 ' H ' ' HG2' ' A' ' 10' ' ' GLU . 6.6 ttmt -66.59 -49.45 66.3 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.199 -0.601 . . . . 0.0 112.187 -178.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -83.95 -10.81 57.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.476 -1.39 . . . . 0.0 109.054 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.496 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 50.3 m-20 -71.78 -3.88 24.58 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.89 179.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.804 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 30.5 t -85.56 149.62 25.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.872 -1.142 . . . . 0.0 108.773 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 64.7 m -57.05 147.65 23.71 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.352 -0.843 . . . . 0.0 109.324 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -52.32 134.15 34.11 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.396 -0.815 . . . . 0.0 109.225 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.47 -0.99 66.12 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.625 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 79.7 m-85 -134.17 150.25 51.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.234 -1.156 . . . . 0.0 110.55 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.04 150.82 25.38 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.804 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 2.8 m -94.0 138.27 32.28 Favored 'General case' 0 N--CA 1.403 -2.823 1 O-C-N 116.281 -4.012 . . . . 0.0 109.931 175.494 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.1 t -135.12 137.96 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.447 -0.783 . . . . 0.0 110.824 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.4 103.83 1.39 Allowed 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.696 ' O ' ' C ' ' A' ' 24' ' ' TRP . . . -93.76 -161.74 0.88 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.696 ' C ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER 14.07 94.93 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.95 0.881 . . . . 0.0 109.47 -178.977 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -49.26 3.42 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.68 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.692 ' H ' ' C ' ' A' ' 24' ' ' TRP . 1.1 m120 -81.34 -56.03 4.32 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.277 -0.889 . . . . 0.0 108.824 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.746 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 172.72 37.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.224 1.011 . . . . 0.0 108.652 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.514 ' HB3' ' HB2' ' A' ' 24' ' ' TRP . 56.4 tp60 -121.57 157.38 30.86 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.586 -1.321 . . . . 0.0 110.547 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.75 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 2.6 m -133.32 150.57 51.86 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 t -143.5 136.44 27.65 Favored 'General case' 0 C--N 1.309 -1.185 0 O-C-N 121.078 -1.013 . . . . 0.0 110.529 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 1.5 m -67.09 144.36 56.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.448 -0.783 . . . . 0.0 109.641 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -148.17 139.07 23.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.553 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.545 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -57.94 175.41 0.2 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.121 -0.987 . . . . 0.0 109.384 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.545 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 O-C-N 120.623 -1.298 . . . . 0.0 109.925 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.564 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 22.0 p . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.645 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -76.6 122.61 6.41 Favored Glycine 0 N--CA 1.486 2.014 0 C-N-CA 118.669 -1.729 . . . . 0.0 108.929 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.697 ' O ' ' C ' ' A' ' 4' ' ' LYS . 14.9 m -98.97 175.21 6.0 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.285 . . . . 0.0 108.148 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.697 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER -25.72 128.38 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.176 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.484 ' HB3' ' O ' ' A' ' 4' ' ' LYS . 14.4 ttp180 60.33 82.19 0.16 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.224 -0.923 . . . . 0.0 109.134 -178.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 176.44 129.02 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.226 -0.921 . . . . 0.0 110.582 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.585 ' HA ' ' O ' ' A' ' 29' ' ' SER . 2.0 t90 -44.66 133.25 6.04 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.572 0.701 . . . . 0.0 110.565 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.713 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 27.6 p -114.12 135.23 54.26 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -90.03 -37.04 14.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.618 -1.301 . . . . 0.0 109.487 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.54 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 0.2 OUTLIER -146.37 177.85 8.7 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.3 -0.875 . . . . 0.0 108.846 178.98 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -61.4 -45.5 94.09 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.328 0.585 . . . . 0.0 110.074 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -81.06 -15.52 55.83 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 119.667 -1.895 . . . . 0.0 112.214 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.54 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -71.81 -7.79 50.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.105 -0.997 . . . . 0.0 111.243 -178.286 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.51 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 51.3 m -88.13 142.79 27.48 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.446 -1.409 . . . . 0.0 107.758 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.503 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -53.09 148.97 7.27 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.542 -178.523 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -49.17 120.19 3.82 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.134 0.968 . . . . 0.0 109.746 -178.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.94 -1.27 35.74 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 4' ' ' LYS . 82.7 m-85 -131.15 144.82 51.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.449 -1.03 . . . . 0.0 108.587 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 9.2 p-10 -118.31 169.08 10.03 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.028 -1.045 . . . . 0.0 110.333 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.1 t -89.45 128.42 35.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.667 -0.645 . . . . 0.0 109.436 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.5 t -127.71 130.74 70.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.367 -0.833 . . . . 0.0 109.459 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -72.79 118.38 15.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.181 -0.949 . . . . 0.0 109.066 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -89.94 95.16 10.1 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.412 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p-90 -52.87 -40.46 63.45 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.523 -0.736 . . . . 0.0 110.517 -178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.642 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.4 OUTLIER -73.9 136.56 43.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.854 -1.154 . . . . 0.0 108.606 179.873 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER 55.95 13.22 1.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.28 -0.888 . . . . 0.0 109.07 -178.389 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 1.3 mp0 50.51 -155.53 0.12 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.408 -0.808 . . . . 0.0 109.888 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.681 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 3.2 tp-100 63.56 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.261 -0.899 . . . . 0.0 110.062 -179.334 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.655 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 70.6 m -100.9 157.03 17.03 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.334 178.341 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.6 t -136.69 139.06 41.69 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.233 -0.917 . . . . 0.0 110.653 -179.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.713 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 91.3 m -66.87 148.24 52.2 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.494 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 4.6 pt-20 -144.25 139.69 28.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.972 -1.08 . . . . 0.0 108.982 178.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 33' ' ' ARG . 3.9 ttm180 -64.21 155.01 33.15 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.311 -0.868 . . . . 0.0 110.735 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.3 -1.58 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.733 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.674 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -73.57 150.17 42.9 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.464 ' O ' ' C ' ' A' ' 4' ' ' LYS . 50.2 m -105.26 -170.2 1.71 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.355 -1.085 . . . . 0.0 109.505 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.464 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.6 OUTLIER -37.52 121.84 0.89 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.219 -0.925 . . . . 0.0 109.91 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.612 ' N ' ' O ' ' A' ' 31' ' ' CYS . 42.5 ttp180 48.89 86.05 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 178.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.476 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -173.03 124.23 0.42 Allowed 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 121.975 0.893 . . . . 0.0 109.668 -178.394 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.714 ' HA ' ' O ' ' A' ' 29' ' ' SER . 34.7 t90 -24.54 142.67 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.21 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.678 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -130.95 157.08 43.91 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.731 0.777 . . . . 0.0 110.574 179.379 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 30.5 mttm -88.49 -40.82 13.16 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 177.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.52 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 51.1 mm-40 -159.41 -173.65 4.28 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 121.541 0.686 . . . . 0.0 109.173 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.584 ' HG3' ' OD1' ' A' ' 19' ' ' ASN . 53.5 tttm -67.94 -45.82 73.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.363 -0.836 . . . . 0.0 109.986 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -12.83 60.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.529 -0.732 . . . . 0.0 110.099 -178.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.52 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 12.4 m-20 -85.4 2.58 43.82 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.045 -1.034 . . . . 0.0 111.549 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 3.8 m -85.38 143.38 28.67 Favored 'General case' 0 C--N 1.308 -1.237 0 O-C-N 120.428 -1.42 . . . . 0.0 108.408 179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.733 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 11.0 m -54.56 138.92 39.69 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.323 -0.861 . . . . 0.0 108.708 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 44.4 t -34.12 148.49 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.404 ' O ' ' HD3' ' A' ' 33' ' ' ARG . . . 74.94 1.38 62.53 Favored Glycine 0 N--CA 1.493 2.44 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.706 ' HB3' ' HB3' ' A' ' 31' ' ' CYS . 62.8 m-85 -135.93 156.57 48.57 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.5 -1.589 . . . . 0.0 111.157 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 1.055 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 32.1 t30 -131.05 169.24 16.13 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.727 . . . . 0.0 110.391 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 6.3 t -90.35 109.08 20.2 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.915 -1.116 . . . . 0.0 109.94 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.679 HG21 ' CD ' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -103.58 134.22 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.493 -0.754 . . . . 0.0 109.797 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.536 ' CD2' ' O ' ' A' ' 23' ' ' ALA . 65.4 t80 -67.91 141.49 56.35 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.044 -1.035 . . . . 0.0 108.966 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -85.52 -148.82 0.12 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.299 -0.876 . . . . 0.0 110.01 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.416 ' CZ3' ' O ' ' A' ' 22' ' ' TYR . 0.8 OUTLIER -175.01 -49.0 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.253 -179.336 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.429 ' CE1' ' OD1' ' A' ' 26' ' ' ASN . 4.2 p90 -86.78 -34.29 19.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.61 -1.307 . . . . 0.0 108.375 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.429 ' OD1' ' CE1' ' A' ' 25' ' ' TYR . 20.1 p-10 -109.57 10.34 25.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.478 -0.764 . . . . 0.0 109.361 178.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.57 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 98.6 mm-40 54.59 -167.22 0.08 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.101 -0.999 . . . . 0.0 110.77 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 64.06 -168.36 0.21 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.537 -0.727 . . . . 0.0 109.274 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.714 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 58.9 m -131.84 147.15 52.46 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.365 -0.834 . . . . 0.0 109.441 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.8 p -128.37 143.11 50.96 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 1.055 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 77.7 m -67.63 148.08 51.85 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.006 -1.059 . . . . 0.0 109.874 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.679 ' CD ' HG21 ' A' ' 21' ' ' VAL . 0.7 OUTLIER -147.71 149.7 32.93 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.117 -0.989 . . . . 0.0 110.275 179.463 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -59.79 135.51 57.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.625 -1.297 . . . . 0.0 109.26 -179.11 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? . . . . . 0 N--CA 1.483 1.206 0 O-C-N 121.241 -0.912 . . . . 0.0 111.877 -177.938 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.649 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 121.171 0.51 . . . . 0.0 109.689 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.573 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -59.51 -89.99 0.02 OUTLIER Glycine 0 N--CA 1.494 2.513 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.287 -178.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 1.3 t 87.13 -173.78 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.683 -0.893 . . . . 0.0 110.54 -178.402 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.597 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 71.5 tttt -43.66 126.64 4.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.569 -0.707 . . . . 0.0 109.842 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.597 ' HG2' ' HG2' ' A' ' 4' ' ' LYS . 0.4 OUTLIER 46.92 81.26 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -177.669 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.81 126.78 0.1 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.242 -177.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.81 ' HA ' ' O ' ' A' ' 29' ' ' SER . 31.8 t90 -52.77 137.74 30.85 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.662 0.744 . . . . 0.0 111.692 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.707 ' SG ' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -122.03 170.98 9.3 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.478 178.405 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.707 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -121.98 -36.8 2.94 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.521 -1.362 . . . . 0.0 108.041 177.871 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.728 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 44.6 mt-10 -148.36 169.51 20.0 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 tptm -59.05 -23.77 62.28 Favored 'General case' 0 C--N 1.292 -1.893 0 O-C-N 121.076 -1.015 . . . . 0.0 108.72 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -93.33 -33.98 13.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.612 -0.68 . . . . 0.0 111.282 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.472 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -63.74 -6.98 6.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.006 -1.059 . . . . 0.0 110.58 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.745 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.4 t -93.96 160.77 14.58 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.497 -0.752 . . . . 0.0 108.998 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.649 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 94.1 m -56.78 140.0 49.14 Favored 'General case' 0 C--N 1.306 -1.312 0 O-C-N 120.985 -1.072 . . . . 0.0 109.108 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.43 129.31 41.24 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 104.0 -4.14 45.26 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.745 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 95.3 m-85 -117.99 141.18 48.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.942 -1.328 . . . . 0.0 109.32 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.835 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 5.3 p-10 -90.91 144.03 26.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.323 -0.86 . . . . 0.0 108.739 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.728 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 18.0 m -90.31 136.29 33.14 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.576 0.703 . . . . 0.0 111.253 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 29' ' ' SER . 41.9 t -117.25 101.48 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -73.85 114.46 12.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.338 -0.851 . . . . 0.0 109.42 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -94.93 88.81 5.4 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.279 -0.888 . . . . 0.0 110.506 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.621 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -51.86 -2.05 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.384 -0.823 . . . . 0.0 109.941 178.489 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.588 ' H ' ' C ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -60.37 -49.31 78.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.083 -1.011 . . . . 0.0 109.637 -179.047 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.405 ' OD1' ' HB3' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -151.27 46.75 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.234 -0.916 . . . . 0.0 109.286 179.464 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 52.28 37.95 23.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.466 -0.771 . . . . 0.0 110.165 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.783 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 44.3 tt0 -120.36 114.14 21.4 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.21 -0.931 . . . . 0.0 109.513 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.81 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.7 m -95.24 172.37 8.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.948 -1.095 . . . . 0.0 109.277 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 20' ' ' CYS . 1.6 t -144.56 -157.81 0.82 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.236 -0.915 . . . . 0.0 109.849 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.835 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -165.73 138.49 4.21 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.018 -179.729 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -145.2 144.25 30.74 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.71 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 1.1 ptp85 -57.57 110.27 0.85 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.151 -0.968 . . . . 0.0 111.45 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.649 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 178.143 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.503 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 19.4 p . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.626 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -88.41 114.7 4.27 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.41 -1.376 . . . . 0.0 109.892 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 4' ' ' LYS . 3.6 m -94.31 -159.52 0.71 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.142 -1.211 . . . . 0.0 107.736 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 11.6 tmtt? -46.9 147.54 1.31 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.426 -1.421 . . . . 0.0 108.286 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 5' ' ' ARG . 8.1 ptm180 39.2 78.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.563 1.173 . . . . 0.0 109.286 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.71 125.96 0.08 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.442 -0.787 . . . . 0.0 109.266 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' SER . 72.5 t90 -45.06 134.1 6.19 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.578 0.704 . . . . 0.0 111.729 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -123.83 136.03 54.13 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.858 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HB3' ' CG ' ' A' ' 13' ' ' ASP . 31.0 tttm -82.73 -40.87 19.97 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.656 ' HG2' ' N ' ' A' ' 11' ' ' LYS . 62.8 tt0 -156.55 179.58 9.12 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.276 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.656 ' N ' ' HG2' ' A' ' 10' ' ' GLU . 1.6 ttpm? -58.87 -43.96 90.96 Favored 'General case' 0 C--N 1.285 -2.214 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.874 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -69.63 -37.79 76.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.358 -0.839 . . . . 0.0 110.582 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.474 ' CG ' ' HB3' ' A' ' 9' ' ' LYS . 10.3 t70 -60.34 -23.47 64.27 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.779 -1.201 . . . . 0.0 110.577 -178.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.3 t -79.56 142.96 35.24 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.024 -1.048 . . . . 0.0 108.833 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -51.47 121.95 7.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.835 0.826 . . . . 0.0 109.429 -177.759 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' CYS . 1.3 t -38.1 137.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.274 0.559 . . . . 0.0 109.523 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.79 -14.24 58.96 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 67.7 m-85 -111.23 150.47 29.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.994 -1.298 . . . . 0.0 110.312 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.628 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.9 t30 -97.46 132.24 43.35 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.442 -0.787 . . . . 0.0 109.93 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.724 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 5.3 m -85.94 143.01 28.41 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.276 -0.89 . . . . 0.0 109.863 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 30' ' ' SER . 0.3 OUTLIER -134.61 143.57 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.625 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -109.94 111.78 23.38 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 108.717 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.636 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -89.64 93.36 9.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.914 -1.116 . . . . 0.0 109.264 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -54.23 -38.14 65.4 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.403 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.611 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -60.37 -46.65 89.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.947 -1.096 . . . . 0.0 108.931 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.401 ' C ' ' H ' ' A' ' 28' ' ' GLN . 81.1 m-20 -92.45 -6.75 49.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.191 -0.943 . . . . 0.0 108.8 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.636 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.1 OUTLIER 58.72 6.48 0.62 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.432 -0.793 . . . . 0.0 109.474 -179.831 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.401 ' H ' ' C ' ' A' ' 26' ' ' ASN . 29.1 mm100 -109.99 137.19 48.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.346 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.694 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.4 m -93.82 144.5 25.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.083 -1.011 . . . . 0.0 108.427 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.477 ' O ' HG12 ' A' ' 21' ' ' VAL . 13.6 p -142.93 127.98 18.51 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.372 -0.83 . . . . 0.0 109.776 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -69.85 160.45 31.77 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.342 -0.849 . . . . 0.0 110.545 -179.945 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -145.18 141.28 28.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.541 -0.724 . . . . 0.0 109.057 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.455 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -70.19 128.94 37.99 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.594 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 94.5 mttt . . . . . 0 C--N 1.303 -1.431 0 O-C-N 120.856 -1.152 . . . . 0.0 109.855 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.543 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 25.5 p . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.99 129.94 9.82 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 4' ' ' LYS . 29.6 m -99.28 -170.48 1.92 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -1.114 . . . . 0.0 108.541 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' A' ' 3' ' ' SER . 48.4 tttm -46.87 128.73 11.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.555 -1.341 . . . . 0.0 107.565 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 62.09 79.36 0.26 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.361 -0.935 . . . . 0.0 108.635 -178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.55 129.97 0.1 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.246 -0.908 . . . . 0.0 109.927 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.795 ' HA ' ' O ' ' A' ' 29' ' ' SER . 45.4 t90 -53.27 138.47 32.16 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.424 0.63 . . . . 0.0 111.961 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.557 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -122.2 160.68 24.68 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.505 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.497 ' N ' ' OD2' ' A' ' 13' ' ' ASP . 18.3 tttt -85.78 -45.83 11.24 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.285 -0.884 . . . . 0.0 109.202 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.597 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 93.1 mt-10 -145.19 -167.34 2.65 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.661 0.744 . . . . 0.0 109.263 -179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.694 ' HZ1' HD21 ' A' ' 38' ' ' LEU . 16.9 tptt -62.67 -40.92 98.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.829 -0.545 . . . . 0.0 110.253 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -87.52 -3.07 59.0 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.112 -0.993 . . . . 0.0 110.761 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.597 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 24.8 t70 -80.93 -3.6 52.04 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.874 -1.141 . . . . 0.0 111.951 -177.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 34.2 m -86.09 145.08 27.2 Favored 'General case' 0 C--N 1.308 -1.233 0 O-C-N 120.298 -1.501 . . . . 0.0 108.862 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.543 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 72.5 m -51.39 161.67 0.43 Allowed 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 -179.059 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.532 ' HA ' ' CB ' ' A' ' 43' ' ' CYS . 1.0 OUTLIER -58.33 137.55 57.11 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.843 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.41 4.3 87.98 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -130.95 141.53 50.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -1.205 . . . . 0.0 110.414 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 31.3 p-10 -104.36 166.91 10.09 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.936 -1.102 . . . . 0.0 109.181 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 18.8 t -102.81 130.69 49.88 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.239 -0.913 . . . . 0.0 109.569 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.05 128.55 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -79.3 123.75 27.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.082 -1.012 . . . . 0.0 109.121 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.578 ' HB1' ' CE2' ' A' ' 25' ' ' TYR . . . -101.57 74.2 1.5 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.285 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.1 p-90 -54.55 -36.06 63.91 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.094 -1.004 . . . . 0.0 109.786 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.578 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -56.64 -26.07 55.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.0 109.361 -179.723 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.557 ' ND2' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -141.73 28.85 1.75 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.947 . . . . 0.0 108.897 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 23' ' ' ALA . 5.9 mp0 48.89 -171.0 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.523 -0.736 . . . . 0.0 109.23 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.46 ' O ' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER 57.87 153.93 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.36 -0.838 . . . . 0.0 110.196 179.533 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.795 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 40.4 m -114.69 132.76 56.3 Favored 'General case' 1 C--O 1.148 -4.243 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.328 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.7 p -107.91 127.09 53.44 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.591 0.71 . . . . 0.0 110.75 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 79.9 m -71.66 148.92 46.03 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.443 -0.786 . . . . 0.0 110.263 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.501 ' O ' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -147.02 149.56 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.73 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.616 ' O ' ' CB ' ' A' ' 34' ' ' LYS . 10.4 ptt180 -51.93 -165.24 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.055 -1.028 . . . . 0.0 111.66 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.616 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 91.7 mttt 121.4 106.6 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 123.592 0.757 . . . . 0.0 109.807 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 39.7 m0 -114.02 -74.04 0.64 Allowed 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 123.224 1.488 . . . . 0.0 108.593 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -63.03 -31.2 72.29 Favored 'General case' 0 C--N 1.29 -2.014 0 O-C-N 120.806 -1.184 . . . . 0.0 109.722 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -77.44 12.74 1.44 Allowed 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.399 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.694 HD21 ' HZ1' ' A' ' 11' ' ' LYS . 4.1 tp -131.04 145.94 52.2 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 120.994 -1.066 . . . . 0.0 109.884 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.503 ' O ' ' N ' ' A' ' 41' ' ' GLY . 3.2 m-85 -57.33 142.85 42.01 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.467 -0.77 . . . . 0.0 109.748 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.428 ' C ' ' O ' ' A' ' 39' ' ' PHE . 75.9 p 42.62 -95.47 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.459 -0.776 . . . . 0.0 109.909 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 42' ' ' GLU . . . 123.32 -133.68 9.09 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 108.908 -1.677 . . . . 0.0 108.908 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.556 ' O ' ' O ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER 54.42 112.11 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.357 -1.084 . . . . 0.0 108.584 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.532 ' CB ' ' HA ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.105 -0.997 . . . . 0.0 110.252 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.513 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 28.8 p . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.637 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -73.29 118.45 6.27 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 108.19 -1.964 . . . . 0.0 108.19 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.7 m -99.02 -161.21 0.86 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.306 . . . . 0.0 109.056 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -53.14 125.06 16.18 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 6' ' ' ALA . 96.2 mtt-85 56.46 86.82 0.06 Allowed 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 178.52 135.25 0.08 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.771 0.796 . . . . 0.0 109.955 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' SER . 40.7 t90 -50.54 143.57 9.06 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.603 0.716 . . . . 0.0 111.061 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.63 148.37 46.51 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -95.24 -32.04 13.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.918 -1.114 . . . . 0.0 109.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 78.4 mm-40 -154.65 177.92 10.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.354 -0.841 . . . . 0.0 108.885 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -60.35 -48.86 79.94 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.42 ' C ' ' H ' ' A' ' 14' ' ' CYS . 16.4 ttmm -76.47 -35.03 58.66 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.741 -0.6 . . . . 0.0 111.128 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.49 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 7.8 m-20 -59.87 -1.3 0.27 Allowed 'General case' 0 N--CA 1.482 1.14 0 O-C-N 121.004 -1.06 . . . . 0.0 110.618 -178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.692 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 47.9 t -90.58 147.68 23.18 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.021 -1.049 . . . . 0.0 108.753 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.513 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -58.1 139.83 53.94 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.217 -0.927 . . . . 0.0 109.677 -179.328 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 126.22 21.41 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.831 -0.747 . . . . 0.0 109.024 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.62 -6.78 24.33 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.692 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 86.0 m-85 -128.69 143.75 51.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.307 -1.114 . . . . 0.0 110.792 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.542 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 65.5 t30 -102.9 145.84 29.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.494 -0.754 . . . . 0.0 109.123 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.4 t -86.95 128.92 35.06 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.031 -1.043 . . . . 0.0 109.143 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 88.3 t -128.6 136.38 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.568 -0.707 . . . . 0.0 110.061 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -66.63 140.41 57.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.409 -0.807 . . . . 0.0 109.305 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.643 ' HB1' ' OD1' ' A' ' 26' ' ' ASN . . . -87.2 -142.58 0.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.519 -0.738 . . . . 0.0 110.27 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.518 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 8.9 p90 -172.22 -42.15 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.991 -0.683 . . . . 0.0 111.188 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.518 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -100.01 11.03 40.3 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.41 -1.432 . . . . 0.0 110.078 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.643 ' OD1' ' HB1' ' A' ' 23' ' ' ALA . 3.1 p-10 -140.42 2.41 1.85 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.448 -0.783 . . . . 0.0 109.127 178.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.3 mm-40 46.79 34.21 2.49 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.089 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 28' ' ' GLN . 19.1 mm-40 -122.57 -167.79 1.63 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.51 -0.744 . . . . 0.0 109.276 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.705 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.2 m -127.86 123.41 35.02 Favored 'General case' 0 C--O 1.181 -2.54 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 p -112.8 120.01 39.99 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.194 -0.941 . . . . 0.0 110.143 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -67.39 143.61 56.22 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.716 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -148.02 134.56 19.77 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.62 ' O ' ' CD1' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -62.6 110.8 1.82 Allowed 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.15 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.401 ' HG2' ' H ' ' A' ' 34' ' ' LYS . 46.5 pttt -68.94 -13.31 62.37 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 120.973 -1.08 . . . . 0.0 111.286 -178.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.744 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 36.4 m95 57.43 -162.05 0.21 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.996 -1.065 . . . . 0.0 109.441 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.744 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 98.7 mttt 90.73 -1.98 0.23 Allowed 'General case' 0 N--CA 1.495 1.822 0 CA-C-O 120.982 0.42 . . . . 0.0 109.954 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.609 ' OH ' ' HD3' ' A' ' 33' ' ' ARG . 30.8 p90 -131.88 79.47 1.87 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.774 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.694 ' O ' ' C ' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -64.94 157.18 28.79 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.694 ' C ' ' O ' ' A' ' 38' ' ' LEU . 0.4 OUTLIER 13.77 78.57 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 121.852 0.834 . . . . 0.0 109.87 -178.477 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.5 m -163.36 145.15 9.69 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.22 146.22 43.46 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.492 ' CD ' ' CZ ' ' A' ' 37' ' ' TYR . 1.9 tt0 -142.59 156.94 45.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.405 -1.056 . . . . 0.0 109.513 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.402 ' OXT' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 117.944 -1.027 . . . . 0.0 109.276 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.488 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 26.2 p . . . . . 0 N--CA 1.489 1.485 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.51 138.39 28.83 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 108.694 -1.762 . . . . 0.0 108.694 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.541 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 26.1 t -100.7 -138.63 0.33 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.281 -1.129 . . . . 0.0 108.701 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.541 ' N ' ' OG ' ' A' ' 3' ' ' SER . 12.7 tmtt? -61.39 128.43 36.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.675 -1.265 . . . . 0.0 107.745 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.682 ' N ' ' O ' ' A' ' 31' ' ' CYS . 45.0 ptt85 41.76 90.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 122.578 1.18 . . . . 0.0 108.92 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -169.59 139.15 2.0 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-O 122.039 0.923 . . . . 0.0 109.377 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.729 ' HE1' ' HZ2' ' A' ' 9' ' ' LYS . 0.6 OUTLIER -47.07 131.63 12.42 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.713 0.768 . . . . 0.0 112.217 -177.603 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.587 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -121.09 152.32 38.82 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 177.97 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.729 ' HZ2' ' HE1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -98.6 -28.37 13.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.897 -1.127 . . . . 0.0 109.058 178.618 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.648 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 24.5 mt-10 -145.33 179.2 7.55 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-O 121.761 0.791 . . . . 0.0 109.825 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -61.26 -47.61 85.23 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.443 -0.786 . . . . 0.0 109.003 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 14' ' ' CYS . 85.1 tttt -83.56 -22.35 32.38 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.397 -0.815 . . . . 0.0 109.898 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.648 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 14.7 t70 -47.33 -11.88 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.019 -1.05 . . . . 0.0 109.882 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.547 ' N ' ' O ' ' A' ' 12' ' ' LYS . 59.9 m -83.25 133.57 34.99 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.475 ' C ' ' O ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -42.07 145.99 0.32 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.358 -0.839 . . . . 0.0 109.378 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -49.67 125.42 11.51 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.557 -0.714 . . . . 0.0 109.209 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.01 0.25 41.6 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -129.84 141.95 50.75 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.609 -0.936 . . . . 0.0 109.501 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.699 ' ND2' ' O ' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -103.56 158.89 16.05 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.212 -0.93 . . . . 0.0 109.24 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 39.1 t -92.37 112.67 24.7 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.763 -1.211 . . . . 0.0 110.031 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.49 ' O ' ' CB ' ' A' ' 29' ' ' SER . 75.5 t -89.28 132.07 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -81.02 124.53 29.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.245 -0.91 . . . . 0.0 109.292 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.781 ' HB1' ' CE2' ' A' ' 25' ' ' TYR . . . -114.03 118.63 34.64 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.949 0.88 . . . . 0.0 110.55 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.584 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -54.29 -11.95 0.58 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.781 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 34.7 p90 -94.75 129.92 41.49 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.371 -1.456 . . . . 0.0 110.102 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.604 ' O ' ' C ' ' A' ' 27' ' ' GLN . 68.1 m-20 55.14 34.16 22.02 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.478 -0.764 . . . . 0.0 109.446 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.604 ' C ' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 29.44 43.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 122.261 1.029 . . . . 0.0 108.592 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.59 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 1.2 tm0? -111.36 163.62 13.79 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.667 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 14.6 m -125.8 148.33 49.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.185 -0.947 . . . . 0.0 110.473 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -108.44 117.21 33.57 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.63 -0.669 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.682 ' O ' ' N ' ' A' ' 5' ' ' ARG . 96.6 m -65.74 130.55 43.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.955 -1.091 . . . . 0.0 109.131 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.699 ' O ' ' ND2' ' A' ' 19' ' ' ASN . 95.5 mt-10 -146.98 135.09 21.54 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.966 -1.084 . . . . 0.0 110.639 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -74.92 107.45 7.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.402 -0.811 . . . . 0.0 110.183 178.739 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HG3' HD21 ' A' ' 19' ' ' ASN . 0.1 OUTLIER 178.03 41.92 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.563 -1.336 . . . . 0.0 111.461 178.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.573 ' O ' ' N ' ' A' ' 37' ' ' TYR . 5.1 m95 -120.54 -165.28 1.18 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.024 -1.047 . . . . 0.0 108.844 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -62.67 67.73 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.319 -0.863 . . . . 0.0 109.535 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.573 ' N ' ' O ' ' A' ' 35' ' ' TRP . 3.8 m-85 -115.77 44.51 1.89 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.274 -0.891 . . . . 0.0 109.254 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 48.4 tp -62.74 -42.28 99.59 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.083 -1.011 . . . . 0.0 108.4 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.2 t80 178.08 62.4 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -80.7 -4.87 55.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.265 -0.897 . . . . 0.0 110.253 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.6 ' O ' ' HG2' ' A' ' 42' ' ' GLU . . . 65.2 95.56 0.02 OUTLIER Glycine 0 N--CA 1.49 2.249 0 N-CA-C 108.616 -1.794 . . . . 0.0 108.616 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.683 ' O ' ' C ' ' A' ' 43' ' ' CYS . 3.5 pt-20 54.49 116.56 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.677 -0.896 . . . . 0.0 109.356 -179.045 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.683 ' C ' ' O ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.702 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.547 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.4 p . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.01 141.15 35.53 Favored Glycine 0 N--CA 1.487 2.098 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.6 m -108.09 -152.96 0.49 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.378 -1.072 . . . . 0.0 109.207 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.07 118.83 4.35 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.098 -1.001 . . . . 0.0 108.588 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.543 ' HE ' ' CA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 53.96 91.55 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 122.087 0.946 . . . . 0.0 108.555 -178.798 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -175.77 125.7 0.22 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.844 0.83 . . . . 0.0 109.092 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.648 ' HA ' ' O ' ' A' ' 29' ' ' SER . 1.9 t90 -40.15 138.31 0.87 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.611 0.719 . . . . 0.0 110.856 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -111.57 140.28 46.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.831 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.6 tttm -86.71 -37.68 17.7 Favored 'General case' 0 C--N 1.294 -1.814 0 O-C-N 121.415 -0.803 . . . . 0.0 109.09 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.64 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 28.2 mt-10 -151.26 162.77 40.3 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.519 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -57.55 -32.64 67.31 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.104 -0.997 . . . . 0.0 108.611 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.421 ' HD2' ' HZ2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -87.5 -4.63 58.99 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.065 -1.022 . . . . 0.0 109.57 178.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.544 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -92.64 5.15 52.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.811 -1.181 . . . . 0.0 111.651 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.776 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 16.5 m -88.39 140.2 29.71 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.268 -1.52 . . . . 0.0 107.665 178.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 73.6 m -51.11 146.81 5.96 Favored 'General case' 0 N--CA 1.502 2.132 0 C-N-CA 117.078 -1.849 . . . . 0.0 110.407 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -52.01 118.63 3.59 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 121.195 -0.94 . . . . 0.0 110.259 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.05 -14.45 11.16 Favored Glycine 1 N--CA 1.534 5.167 0 C-N-CA 119.214 -1.47 . . . . 0.0 109.748 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -125.86 144.69 50.56 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.33 -1.1 . . . . 0.0 109.156 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.638 HD22 ' HG3' ' A' ' 34' ' ' LYS . 1.2 p30 -108.64 175.73 5.36 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.039 -1.038 . . . . 0.0 109.404 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.64 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 1.6 m -90.5 135.84 33.44 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.851 -1.156 . . . . 0.0 110.472 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.63 100.56 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -67.32 126.14 28.32 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.12 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -89.15 100.83 13.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.275 -0.89 . . . . 0.0 108.931 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.486 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -50.17 -27.65 6.19 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 108.869 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.456 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -99.41 149.5 23.12 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.645 ' ND2' ' O ' ' A' ' 26' ' ' ASN . 0.1 OUTLIER 51.29 12.47 0.14 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.968 -1.082 . . . . 0.0 108.852 -178.765 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.503 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 97.1 mm-40 43.94 -148.81 0.06 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.512 -0.742 . . . . 0.0 109.119 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 27' ' ' GLN . 98.6 mt-30 60.39 134.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.264 -0.897 . . . . 0.0 110.214 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.648 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 34.2 m -96.89 170.47 9.14 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.456 -0.778 . . . . 0.0 109.537 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -141.21 129.69 22.56 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.321 -0.862 . . . . 0.0 109.431 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 96.5 m -72.27 131.27 42.47 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.615 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.559 ' O ' ' ND2' ' A' ' 19' ' ' ASN . 1.0 OUTLIER -150.05 128.41 12.14 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.152 -0.968 . . . . 0.0 109.979 179.471 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.499 ' C ' ' CD ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.69 146.57 54.55 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.445 -0.784 . . . . 0.0 109.647 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.638 ' HG3' HD22 ' A' ' 19' ' ' ASN . 42.1 mttt -126.14 -99.32 0.39 Allowed 'General case' 0 N--CA 1.485 1.278 0 O-C-N 121.248 -0.908 . . . . 0.0 110.48 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -118.5 158.73 24.81 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.825 0.821 . . . . 0.0 109.884 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.1 tttp -66.53 -10.04 40.98 Favored 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.713 -0.617 . . . . 0.0 110.635 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.566 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -67.45 -8.56 34.28 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 120.912 -1.117 . . . . 0.0 108.698 -179.02 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.602 ' O ' ' O ' ' A' ' 39' ' ' PHE . 23.4 tp -62.41 -35.26 78.67 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.61 ' O ' ' CB ' ' A' ' 40' ' ' THR . 0.1 OUTLIER -50.93 -164.04 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 178.617 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.61 ' CB ' ' O ' ' A' ' 39' ' ' PHE . 2.5 m 87.14 25.99 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.102 -0.999 . . . . 0.0 109.676 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.68 -0.89 42.27 Favored Glycine 0 N--CA 1.496 2.652 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.498 ' OE1' ' N ' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -127.05 120.15 28.3 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.154 -1.204 . . . . 0.0 109.667 179.734 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.498 ' N ' ' OE1' ' A' ' 42' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.303 -1.434 0 CA-C-O 117.974 -1.012 . . . . 0.0 108.711 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.582 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.6 p . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 7' ' ' TRP . . . -63.02 120.12 20.01 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.562 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 10.9 t -96.69 -163.49 1.05 Allowed 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.181 -1.188 . . . . 0.0 108.744 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.562 ' N ' ' OG ' ' A' ' 3' ' ' SER . 15.7 tttp -45.47 121.59 3.09 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.187 -0.946 . . . . 0.0 108.604 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 56.66 86.89 0.06 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.15 152.43 1.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.337 -0.852 . . . . 0.0 110.865 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.64 ' HA ' ' O ' ' A' ' 29' ' ' SER . 20.2 t90 -53.7 154.19 3.95 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.905 0.859 . . . . 0.0 112.213 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.645 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -132.11 136.01 46.83 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -87.95 -46.94 8.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.589 -1.319 . . . . 0.0 107.547 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.783 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 95.7 mt-10 -141.38 178.41 7.45 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.466 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.1 tttt -58.38 -45.98 87.25 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.516 -0.874 . . . . 0.0 109.432 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' NZ ' ' CB ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.04 -34.33 71.17 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.198 -0.939 . . . . 0.0 110.44 179.351 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.602 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 3.4 t70 -52.91 -6.76 0.06 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.292 -0.88 . . . . 0.0 112.045 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.711 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 12.7 m -86.47 146.46 26.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 120.404 -1.435 . . . . 0.0 108.904 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.582 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 71.0 m -52.87 137.05 33.07 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -46.03 122.97 4.19 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.396 -0.815 . . . . 0.0 109.753 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.61 -8.07 24.15 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -125.52 142.52 51.46 Favored 'General case' 0 C--O 1.286 2.989 0 O-C-N 121.092 -1.24 . . . . 0.0 111.829 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -100.12 163.2 12.52 Favored 'General case' 0 N--CA 1.499 2.007 1 O-C-N 116.067 -4.145 . . . . 0.0 108.952 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.783 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 24.8 m -90.19 130.71 36.3 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 120.488 -1.382 . . . . 0.0 109.849 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 30' ' ' SER . 0.3 OUTLIER -133.84 159.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.589 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.438 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 57.2 t80 -102.99 127.47 50.21 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.187 -0.946 . . . . 0.0 110.137 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -93.49 113.0 25.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.161 -0.962 . . . . 0.0 109.257 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.1 p-90 -53.89 1.73 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.323 -0.861 . . . . 0.0 110.74 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.585 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 36.2 p90 -123.91 148.24 47.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.991 -1.068 . . . . 0.0 109.224 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 54.51 17.22 1.55 Allowed 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.894 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.516 ' C ' ' O ' ' A' ' 26' ' ' ASN . 53.7 mm-40 24.94 65.08 0.05 Allowed 'General case' 0 N--CA 1.5 2.048 0 CA-C-O 121.12 0.486 . . . . 0.0 111.459 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.568 ' HB3' HD21 ' A' ' 26' ' ' ASN . 13.8 tt0 -132.42 155.68 48.06 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.232 -0.917 . . . . 0.0 109.742 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.64 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.4 m -90.17 118.64 29.85 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.411 ' O ' HG12 ' A' ' 21' ' ' VAL . 27.3 t -103.98 124.24 48.65 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 120.963 -1.086 . . . . 0.0 111.184 -178.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 88.4 m -67.48 119.24 11.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.134 -0.978 . . . . 0.0 109.316 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.474 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 1.9 pt-20 -144.5 121.31 11.25 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.578 ' NH2' HD23 ' A' ' 38' ' ' LEU . 4.3 tpt180 -70.93 167.05 19.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.683 -1.261 . . . . 0.0 110.194 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.662 ' C ' ' CG ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -127.33 40.67 3.66 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.325 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.682 ' O ' ' C ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 59.13 -87.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.071 -1.018 . . . . 0.0 108.942 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.682 ' C ' ' O ' ' A' ' 35' ' ' TRP . 37.6 mttt 7.91 78.38 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.211 0.529 . . . . 0.0 110.43 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -55.01 79.22 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.878 0.847 . . . . 0.0 109.843 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.858 HD12 ' H ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -57.1 -174.4 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 179.562 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.858 ' H ' HD12 ' A' ' 38' ' ' LEU . 50.5 t80 -166.68 97.42 0.56 Allowed 'General case' 0 C--N 1.306 -1.325 0 O-C-N 120.96 -1.087 . . . . 0.0 109.698 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.751 ' OG1' HD11 ' A' ' 38' ' ' LEU . 2.5 p -159.64 113.76 2.3 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 67.74 -135.87 30.98 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 107.819 -2.112 . . . . 0.0 107.819 -178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -144.8 97.01 2.96 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.904 -1.35 . . . . 0.0 109.826 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.307 -1.254 0 O-C-N 121.043 -1.036 . . . . 0.0 108.991 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.528 ' HB2' ' CA ' ' A' ' 15' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -81.03 132.69 11.4 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.475 ' O ' ' C ' ' A' ' 4' ' ' LYS . 21.7 m -104.45 -162.45 0.89 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.357 -1.084 . . . . 0.0 108.675 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.475 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.9 OUTLIER -44.25 130.93 6.3 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.649 -1.282 . . . . 0.0 108.096 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 mtp85 54.37 82.51 0.09 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.989 -1.069 . . . . 0.0 108.713 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 125.62 0.24 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.996 -1.065 . . . . 0.0 110.514 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.542 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.1 t90 -49.07 131.32 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.419 0.628 . . . . 0.0 111.078 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.525 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -117.87 153.17 33.99 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 178.26 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.72 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 6.8 tmtt? -94.77 -25.19 16.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.03 . . . . 0.0 108.718 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 5.9 pt-20 -165.65 -171.82 2.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.408 -0.807 . . . . 0.0 109.277 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.42 -45.25 94.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.301 -0.874 . . . . 0.0 109.229 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.9 tptp -70.39 -25.26 63.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.327 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.72 ' CG ' ' H ' ' A' ' 9' ' ' LYS . 11.5 t70 -63.75 -17.62 63.22 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.274 -0.891 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.1 m -83.57 122.17 28.2 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 119.943 -1.723 . . . . 0.0 107.961 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.537 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.99 -173.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 122.132 0.967 . . . . 0.0 111.418 -177.81 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.537 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.5 OUTLIER 22.08 -143.23 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.722 177.281 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.692 ' H ' ' CB ' ' A' ' 43' ' ' CYS . . . -89.45 29.94 5.92 Favored Glycine 0 C--N 1.284 -2.348 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.602 ' CD1' ' HB2' ' A' ' 33' ' ' ARG . 91.4 m-85 -82.83 135.41 34.96 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.534 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 17.3 p-10 -99.07 149.0 23.46 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.951 -1.093 . . . . 0.0 109.391 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 15.2 t -90.89 126.27 36.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.148 -0.97 . . . . 0.0 110.152 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 66.7 t -120.25 130.95 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.486 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 14.5 t80 -78.12 122.41 25.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.906 -1.121 . . . . 0.0 109.025 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' TYR . . . -98.38 88.66 4.2 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -7.67 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.099 -1.001 . . . . 0.0 109.469 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.4 m-85 -58.47 -46.69 86.1 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.082 -1.011 . . . . 0.0 109.864 -179.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.433 ' O ' ' C ' ' A' ' 27' ' ' GLN . 9.4 p-10 -147.98 45.63 1.08 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.05 -1.031 . . . . 0.0 109.797 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.486 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 96.6 mm-40 44.12 42.84 5.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.225 -0.922 . . . . 0.0 109.025 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -120.93 138.42 54.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.737 -0.602 . . . . 0.0 109.691 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.542 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 0.7 OUTLIER -95.62 112.95 24.56 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.293 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.0 t -98.52 114.98 27.59 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.042 -1.036 . . . . 0.0 110.831 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 18' ' ' TYR . 89.0 m -67.89 145.22 54.8 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.262 -0.898 . . . . 0.0 109.183 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.534 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 97.8 mt-10 -146.46 107.45 4.16 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.987 -1.071 . . . . 0.0 112.077 -178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.733 ' HD2' ' H ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -79.14 131.84 36.35 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.613 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt -111.65 19.47 18.05 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.699 -1.25 . . . . 0.0 108.44 178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.733 ' H ' ' HD2' ' A' ' 33' ' ' ARG . 32.0 m95 -117.65 -3.3 11.31 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -56.47 27.16 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.655 -0.653 . . . . 0.0 110.686 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.706 ' N ' ' O ' ' A' ' 35' ' ' TRP . 85.6 m-85 -101.58 104.38 15.25 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.919 ' O ' ' HB2' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 70.08 163.6 0.25 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.204 -0.935 . . . . 0.0 108.631 -178.914 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.919 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 0.2 OUTLIER 102.26 176.22 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -74.75 175.87 7.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.224 -0.922 . . . . 0.0 109.725 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.471 ' N ' ' OG1' ' A' ' 40' ' ' THR . . . -58.43 2.11 0.22 Allowed Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.581 ' H ' ' C ' ' A' ' 40' ' ' THR . 80.5 tt0 -94.86 133.89 38.09 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.262 -1.14 . . . . 0.0 108.79 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.692 ' CB ' ' H ' ' A' ' 17' ' ' GLY . 1.2 p . . . . . 0 N--CA 1.496 1.857 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.594 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.786 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 11.0 p . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.068 0.461 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.56 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -66.14 -51.07 47.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.542 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 2.6 t 86.33 -169.2 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.471 0.653 . . . . 0.0 110.298 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 24.4 tttm -52.36 128.63 26.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.345 -0.847 . . . . 0.0 109.366 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttm-85 49.18 84.2 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.56 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.12 139.53 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.809 -0.757 . . . . 0.0 110.46 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.877 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.3 t90 -43.69 127.02 4.84 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.511 0.672 . . . . 0.0 110.878 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.54 ' O ' ' HB2' ' A' ' 29' ' ' SER . 22.0 p -123.98 133.61 53.65 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -91.82 -44.73 8.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.405 -1.434 . . . . 0.0 109.139 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.441 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 18.6 mt-10 -149.72 178.45 8.86 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -61.03 -47.61 85.64 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.59 -0.694 . . . . 0.0 109.989 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.26 -38.16 78.27 Favored 'General case' 0 C--N 1.292 -1.926 0 O-C-N 120.307 -1.495 . . . . 0.0 112.564 178.764 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.441 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 97.2 m-20 -66.98 -10.83 53.78 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.144 -0.972 . . . . 0.0 109.888 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.522 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 22.9 t -91.97 150.95 20.73 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.825 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.786 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.7 OUTLIER -61.89 135.88 57.75 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.38 143.25 6.68 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.761 -1.212 . . . . 0.0 109.039 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.19 -3.64 69.85 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.522 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 48.2 m-85 -125.92 141.28 52.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.297 -1.12 . . . . 0.0 111.284 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.53 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 12.5 p-10 -98.42 144.12 28.13 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 t -88.43 136.31 33.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.555 -0.716 . . . . 0.0 109.691 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.426 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 72.4 t -123.13 131.27 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -102.8 122.64 44.91 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.114 -0.991 . . . . 0.0 108.351 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB1' ' CE1' ' A' ' 25' ' ' TYR . . . -89.34 115.3 26.7 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.752 -1.218 . . . . 0.0 109.498 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.406 ' CD1' ' CD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -50.49 -27.19 6.12 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.623 -0.673 . . . . 0.0 110.06 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.806 ' O ' ' OD1' ' A' ' 26' ' ' ASN . 2.1 p90 -99.23 164.5 12.11 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.003 -1.061 . . . . 0.0 110.175 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.806 ' OD1' ' O ' ' A' ' 25' ' ' TYR . 6.9 p-10 45.78 13.6 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 CA-C-O 121.143 0.497 . . . . 0.0 110.339 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 25' ' ' TYR . 95.3 mm-40 34.0 46.3 0.14 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.616 -0.677 . . . . 0.0 111.04 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.412 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 1.9 tp60 -120.23 127.07 52.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.256 -0.903 . . . . 0.0 109.29 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.877 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.5 m -101.42 150.86 22.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.552 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 27.7 t -149.32 129.43 13.58 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.626 -1.296 . . . . 0.0 111.091 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.5 OUTLIER -73.22 159.95 32.67 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.289 -0.882 . . . . 0.0 111.453 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -146.09 159.03 43.85 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.323 -0.86 . . . . 0.0 110.142 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.583 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -60.76 132.48 54.02 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.699 0.761 . . . . 0.0 111.878 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 5.8 mmmt -150.69 39.68 0.72 Allowed 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.548 ' CD1' ' N ' ' A' ' 35' ' ' TRP . 18.9 m0 64.14 -162.58 0.27 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.7 -0.625 . . . . 0.0 110.122 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.18 23.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.71 -1.244 . . . . 0.0 111.182 -178.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.52 -7.43 4.15 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.894 -1.129 . . . . 0.0 109.979 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' A' ' 39' ' ' PHE . 1.4 mm? -63.25 -44.83 94.05 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.259 -0.901 . . . . 0.0 111.357 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.501 ' O ' ' O ' ' A' ' 38' ' ' LEU . 27.3 m-85 -60.55 -117.6 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.579 -1.325 . . . . 0.0 108.775 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.5 HG23 ' O ' ' A' ' 39' ' ' PHE . 33.3 p -158.58 139.67 13.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.182 -0.949 . . . . 0.0 108.77 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.474 ' O ' ' O ' ' A' ' 40' ' ' THR . . . 44.65 93.98 0.01 OUTLIER Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 63.07 159.73 0.08 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.029 -1.277 . . . . 0.0 108.466 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.494 ' SG ' ' OXT' ' A' ' 43' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.017 -1.052 . . . . 0.0 109.31 -179.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 120.919 0.39 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.614 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -52.98 122.6 21.23 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 108.926 -1.67 . . . . 0.0 108.926 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 14.7 t -102.23 -166.36 1.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -1.119 . . . . 0.0 109.466 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' N ' ' OG ' ' A' ' 3' ' ' SER . 0.5 OUTLIER -39.86 116.52 0.65 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.956 -1.09 . . . . 0.0 109.243 -179.406 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 5' ' ' ARG . 9.6 ttm180 59.97 86.32 0.1 Allowed 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.656 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.61 137.18 0.2 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.104 -0.997 . . . . 0.0 110.436 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.751 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.4 t90 -45.97 136.44 6.54 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.479 0.657 . . . . 0.0 111.94 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.993 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 2.4 p -134.11 152.29 51.77 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.655 -0.653 . . . . 0.0 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.449 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 11.7 mtmt -93.03 -49.26 6.1 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.769 -1.207 . . . . 0.0 108.289 178.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.616 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 34.2 mp0 -138.27 178.7 6.93 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.479 ' HB2' ' HZ2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -60.9 -43.58 98.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.793 -1.192 . . . . 0.0 108.187 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -65.89 -23.09 66.57 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.673 -0.642 . . . . 0.0 109.556 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.616 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 35.0 t70 -67.59 -16.09 63.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.157 -0.965 . . . . 0.0 110.701 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 83.5 m -84.81 127.33 34.08 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 120.789 -1.194 . . . . 0.0 108.128 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.568 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -57.69 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.774 0.797 . . . . 0.0 110.906 -178.452 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 13.0 t 19.6 -139.73 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 122.411 1.1 . . . . 0.0 111.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.532 ' N ' ' SG ' ' A' ' 16' ' ' CYS . . . -97.66 33.34 5.95 Favored Glycine 0 C--N 1.287 -2.177 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.467 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 78.3 m-85 -89.61 142.77 27.37 Favored 'General case' 0 C--N 1.288 -2.077 0 O-C-N 121.792 -0.828 . . . . 0.0 109.67 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -101.49 153.64 19.53 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.394 -0.816 . . . . 0.0 110.446 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.0 t -89.8 139.07 30.94 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.242 -0.911 . . . . 0.0 109.153 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -128.61 163.99 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.417 -0.802 . . . . 0.0 109.064 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.522 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 74.9 t80 -113.85 132.15 56.0 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.274 -0.891 . . . . 0.0 110.544 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -109.55 132.64 53.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.74 . . . . 0.0 110.02 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.424 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -56.9 -46.34 82.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.6 -0.688 . . . . 0.0 111.407 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.424 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -72.92 140.58 47.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.726 -1.233 . . . . 0.0 110.329 -178.226 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.658 ' O ' ' C ' ' A' ' 27' ' ' GLN . 18.9 m120 56.82 25.41 10.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.759 -0.588 . . . . 0.0 110.235 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.658 ' C ' ' O ' ' A' ' 26' ' ' ASN . 50.6 mm-40 21.78 49.25 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.607 ' N ' ' O ' ' A' ' 26' ' ' ASN . 8.8 tt0 -115.57 141.68 47.74 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.393 -0.817 . . . . 0.0 110.248 -178.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.751 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.0 m -92.7 142.85 26.9 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -129.58 133.22 47.06 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.267 -0.896 . . . . 0.0 110.858 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.993 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 99.2 m -70.77 144.07 50.99 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.43 -0.794 . . . . 0.0 110.808 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -151.31 135.52 16.76 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 4.2 tmm_? -58.77 143.55 46.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.22 -0.925 . . . . 0.0 110.285 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.505 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.7 OUTLIER -175.94 -83.51 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 O-C-N 121.511 -0.743 . . . . 0.0 110.025 178.796 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -113.64 -165.19 0.98 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 122.167 0.984 . . . . 0.0 109.933 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.601 ' O ' ' CG ' ' A' ' 37' ' ' TYR . 33.3 tttt -173.33 -55.69 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.711 ' O ' ' CB ' ' A' ' 38' ' ' LEU . 4.7 m-85 176.22 -24.78 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.797 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.711 ' CB ' ' O ' ' A' ' 37' ' ' TYR . 45.3 tp 123.69 173.78 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.662 ' O ' ' O ' ' A' ' 38' ' ' LEU . 0.4 OUTLIER 30.87 107.19 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.129 -0.982 . . . . 0.0 110.669 -179.623 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.461 ' CB ' ' O ' ' A' ' 39' ' ' PHE . 4.2 m 78.37 10.44 1.92 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.633 -0.667 . . . . 0.0 109.298 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -75.64 22.06 1.85 Allowed Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.902 -1.279 . . . . 0.0 109.902 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 40' ' ' THR . 50.6 tp10 -106.74 138.6 42.6 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.286 -1.126 . . . . 0.0 109.57 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.8 t . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 117.904 -1.045 . . . . 0.0 109.343 179.509 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.734 ' HA ' ' O ' ' A' ' 13' ' ' ASP . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.394 0.616 . . . . 0.0 109.969 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.2 150.77 51.99 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 108.336 -1.906 . . . . 0.0 108.336 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . 8.1 t -95.41 -178.07 4.31 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.136 -1.214 . . . . 0.0 108.921 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.728 ' NZ ' HH21 ' A' ' 33' ' ' ARG . 31.7 tttp -47.76 120.84 3.62 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.553 ' HE ' HH22 ' A' ' 33' ' ' ARG . 9.5 mmt85 58.77 86.21 0.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.502 ' O ' ' N ' ' A' ' 31' ' ' CYS . . . -177.5 147.1 0.49 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.281 -0.887 . . . . 0.0 110.757 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.913 ' HA ' ' O ' ' A' ' 29' ' ' SER . 58.9 t90 -39.2 135.4 0.99 Allowed 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.944 0.878 . . . . 0.0 112.165 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.959 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 17.9 p -132.02 157.98 42.71 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.26 -42.54 8.49 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.727 -1.233 . . . . 0.0 108.896 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 2.5 pt-20 -158.21 -170.23 3.05 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -61.52 -43.31 99.09 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.604 -0.685 . . . . 0.0 111.602 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -85.84 -19.43 30.65 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.683 -1.261 . . . . 0.0 112.09 -177.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.734 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 1.1 m-20 -73.15 -0.53 14.42 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 120.507 -1.371 . . . . 0.0 110.793 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 20.6 m -90.58 144.29 25.91 Favored 'General case' 0 C--N 1.308 -1.205 0 O-C-N 120.492 -1.38 . . . . 0.0 109.221 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.564 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.06 125.1 19.06 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.382 -0.823 . . . . 0.0 109.494 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.564 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -28.15 130.3 0.06 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.257 0.551 . . . . 0.0 109.975 -179.672 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.495 ' N ' ' OE2' ' A' ' 42' ' ' GLU . . . 103.02 -13.54 55.96 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.421 ' N ' ' OE2' ' A' ' 42' ' ' GLU . 46.2 m-85 -125.85 146.89 49.62 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.09 -1.241 . . . . 0.0 110.68 -179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.742 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 3.4 t30 -97.57 -166.86 1.44 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.8 t -138.12 130.54 29.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.424 -0.797 . . . . 0.0 109.044 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.3 t -139.38 154.95 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.367 -0.833 . . . . 0.0 110.137 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -75.39 126.36 30.86 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.516 -0.74 . . . . 0.0 109.618 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -105.08 109.68 21.77 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.286 -0.884 . . . . 0.0 110.574 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.468 ' C ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p90 -57.39 -9.5 1.07 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.285 -0.884 . . . . 0.0 111.238 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.437 ' HB3' ' ND2' ' A' ' 26' ' ' ASN . 15.4 t80 -59.78 -47.97 83.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.744 -1.223 . . . . 0.0 110.231 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.57 ' N ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -146.46 51.86 1.12 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.548 -1.345 . . . . 0.0 109.168 178.324 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.455 ' C ' ' O ' ' A' ' 26' ' ' ASN . 7.0 mm100 40.94 31.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.543 -0.723 . . . . 0.0 109.329 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.562 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -119.16 149.75 41.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -179.829 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.913 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.1 m -89.03 160.19 17.21 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.173 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 8.6 t -139.25 134.76 33.1 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.961 -1.087 . . . . 0.0 110.659 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.959 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 94.6 m -70.4 133.94 47.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.163 -0.961 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -150.22 144.45 25.63 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.807 -1.183 . . . . 0.0 110.353 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.728 HH21 ' NZ ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -56.52 163.21 1.85 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.483 -0.761 . . . . 0.0 110.444 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.595 ' O ' ' N ' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -157.59 57.69 0.49 Allowed 'General case' 0 C--N 1.308 -1.238 0 O-C-N 120.796 -1.19 . . . . 0.0 110.594 179.234 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.655 ' CD1' ' N ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER 58.51 -76.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.983 -1.073 . . . . 0.0 110.336 178.237 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.655 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 1.4 mptp? 84.45 29.08 0.07 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.14 0.495 . . . . 0.0 110.441 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -108.13 54.92 0.65 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.248 -0.907 . . . . 0.0 108.654 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.73 HD12 ' H ' ' A' ' 40' ' ' THR . 0.2 OUTLIER -170.14 -150.52 0.08 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.469 -0.77 . . . . 0.0 108.947 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.466 ' O ' ' C ' ' A' ' 40' ' ' THR . 0.5 OUTLIER -57.6 -27.41 62.71 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.604 -1.31 . . . . 0.0 110.489 -179.643 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.73 ' H ' HD12 ' A' ' 38' ' ' LEU . 1.4 t 34.91 -112.93 0.07 Allowed 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.285 0.564 . . . . 0.0 110.298 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.522 ' H ' HG23 ' A' ' 40' ' ' THR . . . 117.73 -20.35 10.96 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.495 ' OE2' ' N ' ' A' ' 17' ' ' GLY . 8.3 tm-20 -101.59 95.46 6.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.525 -0.985 . . . . 0.0 108.911 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.468 ' C ' ' O ' ' A' ' 42' ' ' GLU . 42.4 t . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.835 -1.078 . . . . 0.0 110.014 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.3 p . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.521 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -75.65 131.76 12.39 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 108.685 -1.766 . . . . 0.0 108.685 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 91.9 p -103.57 -145.23 0.37 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -1.081 . . . . 0.0 109.471 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -51.65 120.55 5.31 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.051 -1.031 . . . . 0.0 109.001 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.41 88.16 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.232 -0.918 . . . . 0.0 108.625 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 134.75 0.31 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.717 0.77 . . . . 0.0 109.939 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.88 ' HA ' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -44.74 148.79 0.48 Allowed 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.984 0.897 . . . . 0.0 111.929 -179.099 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.684 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -125.34 153.59 43.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.068 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 87.1 tttt -85.56 -33.69 21.66 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 7.3 mm-40 -164.54 -173.04 2.89 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-O 121.492 0.663 . . . . 0.0 109.632 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -62.79 -48.67 78.13 Favored 'General case' 0 C--O 1.184 -2.351 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.57 ' HZ2' ' CB ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -87.17 2.75 48.96 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 118.471 -1.292 . . . . 0.0 109.528 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.569 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 49.0 m-20 -93.29 4.24 54.31 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.678 -0.639 . . . . 0.0 111.97 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.684 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 1.3 m -84.57 155.94 21.85 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 120.297 -1.502 . . . . 0.0 107.167 179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 2' ' ' GLY . 89.0 m -47.2 166.75 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.916 -1.115 . . . . 0.0 109.215 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.61 130.45 44.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.198 -0.939 . . . . 0.0 110.106 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.793 ' O ' ' NE1' ' A' ' 35' ' ' TRP . . . 83.77 8.04 85.0 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 32' ' ' GLU . 61.4 m-85 -119.3 148.03 43.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.101 -1.235 . . . . 0.0 110.888 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.2 t30 -118.71 157.23 27.87 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.445 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 16.0 t -91.22 132.47 36.09 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.934 -1.103 . . . . 0.0 110.739 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -121.33 131.79 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.62 126.1 26.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.123 -0.985 . . . . 0.0 108.907 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -112.74 108.87 18.05 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.432 -0.793 . . . . 0.0 109.513 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.52 ' CG ' ' N ' ' A' ' 25' ' ' TYR . 5.9 p-90 -53.92 -39.16 65.6 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.102 -0.998 . . . . 0.0 109.324 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' N ' ' CG ' ' A' ' 24' ' ' TRP . 11.5 p90 -71.5 141.57 50.16 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.327 -0.949 . . . . 0.0 108.904 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.456 ' OD1' ' OE1' ' A' ' 28' ' ' GLN . 1.0 OUTLIER 70.22 -4.68 1.49 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.331 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.433 ' H ' ' C ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER 57.62 16.93 3.68 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.777 -0.824 . . . . 0.0 108.777 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.555 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 98.6 mt-30 -113.59 -172.06 2.01 Favored 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.548 -1.345 . . . . 0.0 108.55 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.88 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 50.1 m -121.01 138.43 54.17 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -103.31 139.8 38.26 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 121.424 -0.798 . . . . 0.0 111.234 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 87.9 m -70.92 152.0 44.11 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.377 -0.827 . . . . 0.0 109.653 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -147.57 -156.82 0.75 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.555 ' N ' ' OE1' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -156.85 126.73 6.3 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 122.316 1.055 . . . . 0.0 108.793 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -127.98 24.46 6.02 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.793 ' NE1' ' O ' ' A' ' 17' ' ' GLY . 9.4 p-90 -119.35 -166.03 1.22 Allowed 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 -179.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.887 ' O ' ' HB2' ' A' ' 37' ' ' TYR . 24.7 tttt -172.06 39.59 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.071 -1.018 . . . . 0.0 109.709 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.887 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 11.5 m-85 108.06 32.96 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 123.147 0.579 . . . . 0.0 109.589 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.754 ' O ' ' HB2' ' A' ' 39' ' ' PHE . 81.6 mt -62.06 -44.26 97.07 Favored 'General case' 0 C--N 1.308 -1.237 0 O-C-N 120.664 -1.273 . . . . 0.0 108.882 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.754 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER 139.19 -170.65 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.5 ' O ' ' C ' ' A' ' 41' ' ' GLY . 69.6 p -76.76 -0.86 25.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.312 -0.868 . . . . 0.0 109.503 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.5 ' C ' ' O ' ' A' ' 40' ' ' THR . . . -34.83 -80.1 0.02 OUTLIER Glycine 0 N--CA 1.495 2.603 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.513 ' CD ' ' H ' ' A' ' 42' ' ' GLU . 1.4 pm0 -108.05 117.4 34.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.33 -1.1 . . . . 0.0 109.407 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.41 ' HA ' ' H ' ' A' ' 17' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.304 -1.41 0 O-C-N 120.853 -1.155 . . . . 0.0 108.614 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.479 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.442 0.639 . . . . 0.0 109.78 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.489 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -68.43 -51.23 32.9 Favored Glycine 0 N--CA 1.495 2.594 0 O-C-N 121.382 -0.824 . . . . 0.0 113.436 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.544 ' O ' ' C ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER 80.61 172.62 0.13 Allowed 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.075 -1.25 . . . . 0.0 110.244 -178.203 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.986 ' NZ ' ' HE ' ' A' ' 33' ' ' ARG . 46.4 tttp -28.77 129.56 0.07 Allowed 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.15 -0.969 . . . . 0.0 110.426 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 49.19 78.76 0.09 Allowed 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 3' ' ' SER . . . -171.39 135.87 0.97 Allowed 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.324 -1.35 . . . . 0.0 111.138 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.644 ' HA ' ' O ' ' A' ' 29' ' ' SER . 23.3 t90 -51.43 136.42 25.64 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.651 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.586 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -123.22 147.85 46.46 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 178.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.58 ' HB3' ' OD2' ' A' ' 13' ' ' ASP . 16.0 ttpt -88.94 -46.96 8.49 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.915 -1.115 . . . . 0.0 108.486 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.425 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 1.5 mm-40 -142.93 -179.36 6.31 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.483 ' CE ' ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -61.61 -36.05 79.6 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.678 -1.264 . . . . 0.0 110.181 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -80.72 -8.55 59.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.031 -1.043 . . . . 0.0 109.993 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.58 ' OD2' ' HB3' ' A' ' 9' ' ' LYS . 24.3 t0 -85.01 0.22 52.18 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.813 -1.179 . . . . 0.0 110.894 -179.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 5.3 m -88.64 142.87 27.33 Favored 'General case' 0 C--N 1.309 -1.193 0 O-C-N 120.121 -1.612 . . . . 0.0 108.028 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 3' ' ' SER . 34.6 m -47.87 140.57 6.53 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.342 -0.849 . . . . 0.0 108.888 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.56 137.13 15.74 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.112 -0.993 . . . . 0.0 109.716 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.44 -0.73 78.18 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -124.83 144.95 50.02 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.29 -1.124 . . . . 0.0 110.063 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.519 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 t30 -100.24 153.61 19.13 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.473 -0.767 . . . . 0.0 110.127 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 41.9 t -91.15 114.58 27.15 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.537 0.684 . . . . 0.0 109.245 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -97.06 142.84 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.605 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -103.12 127.13 50.51 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.191 -0.943 . . . . 0.0 109.533 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.14 100.94 13.46 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.203 -0.936 . . . . 0.0 109.36 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.502 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 1.0 OUTLIER -44.14 -27.35 0.39 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.411 -0.806 . . . . 0.0 110.099 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' C ' ' H ' ' A' ' 27' ' ' GLN . 5.9 p90 -98.71 146.34 25.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.957 -1.089 . . . . 0.0 108.16 179.21 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 27' ' ' GLN . 1.1 m120 61.03 -3.43 0.16 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.359 -0.838 . . . . 0.0 109.348 -179.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.52 ' H ' ' C ' ' A' ' 25' ' ' TYR . 3.2 mp0 45.46 50.99 9.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.177 -0.952 . . . . 0.0 109.025 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -115.79 132.88 56.51 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.644 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 13.8 m -96.11 124.39 40.1 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.989 -1.069 . . . . 0.0 110.926 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.432 ' H ' HG12 ' A' ' 21' ' ' VAL . 1.2 p -105.5 118.67 37.15 Favored 'General case' 0 C--N 1.31 -1.147 0 O-C-N 121.273 -0.892 . . . . 0.0 109.792 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.7 m -65.72 142.87 57.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.741 -1.224 . . . . 0.0 108.923 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -142.49 139.71 31.61 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.982 -1.074 . . . . 0.0 110.548 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.986 ' HE ' ' NZ ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -63.97 60.31 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.858 -0.526 . . . . 0.0 112.152 179.779 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' N ' ' O ' ' A' ' 32' ' ' GLU . 1.1 mmmp? -54.64 -2.98 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.236 -1.54 . . . . 0.0 110.627 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.603 ' C ' ' H ' ' A' ' 37' ' ' TYR . 12.9 m95 -118.61 -174.03 2.6 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.033 -1.042 . . . . 0.0 110.301 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.659 ' O ' ' N ' ' A' ' 38' ' ' LEU . 21.7 mmmt -57.6 16.54 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.341 -0.85 . . . . 0.0 111.782 -178.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.603 ' H ' ' C ' ' A' ' 35' ' ' TRP . 1.3 p90 48.04 -3.95 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.218 -0.926 . . . . 0.0 112.052 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.659 ' N ' ' O ' ' A' ' 36' ' ' LYS . 2.6 mt -96.76 -65.32 0.97 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 120.369 -1.457 . . . . 0.0 110.046 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 178.51 -70.9 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.073 -1.017 . . . . 0.0 109.446 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 58.88 77.05 0.32 Allowed 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.11 178.22 41.49 Favored Glycine 0 N--CA 1.487 2.092 0 N-CA-C 108.848 -1.701 . . . . 0.0 108.848 -178.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -92.49 136.45 33.2 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.015 -1.285 . . . . 0.0 109.568 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.296 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.673 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.615 ' O ' ' HB3' ' A' ' 3' ' ' SER . . . -69.04 -59.19 6.06 Favored Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.925 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 2' ' ' GLY . 33.6 t 84.74 -165.28 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.785 -0.832 . . . . 0.0 110.549 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 68.6 tttt -51.64 132.2 30.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.626 -0.671 . . . . 0.0 109.318 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 53.37 78.6 0.14 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HB1' ' CA ' ' A' ' 2' ' ' GLY . . . -178.09 129.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.985 -1.072 . . . . 0.0 110.78 -178.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.491 ' HA ' ' O ' ' A' ' 29' ' ' SER . 38.4 t90 -52.78 117.52 2.99 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.511 -0.743 . . . . 0.0 110.219 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.648 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -109.32 150.66 27.68 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.731 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -92.5 -35.02 13.84 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.511 -1.368 . . . . 0.0 109.423 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.648 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -159.22 -170.16 2.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 109.029 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.571 ' NZ ' ' NZ ' ' A' ' 36' ' ' LYS . 5.7 tptm -60.64 -48.52 81.4 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.903 -1.123 . . . . 0.0 109.43 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -69.84 -41.99 74.19 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.542 -0.724 . . . . 0.0 111.678 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HB3' ' H ' ' A' ' 10' ' ' GLU . 14.4 t70 -54.29 -14.78 1.28 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.796 -1.19 . . . . 0.0 110.429 -178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.659 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 48.5 t -88.95 146.12 25.1 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.029 -1.044 . . . . 0.0 108.851 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.673 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.6 m -54.53 134.82 46.51 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.213 -178.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 123.96 16.23 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.25 -7.22 10.67 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.715 -1.754 . . . . 0.0 108.715 -179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.659 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 97.5 m-85 -125.38 150.98 46.73 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -1.067 . . . . 0.0 110.807 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.65 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 9.3 p-10 -96.57 133.1 41.48 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.0 t -93.4 125.93 38.26 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.354 -0.841 . . . . 0.0 109.763 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 21' ' ' VAL . 3.2 p -119.54 114.12 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -81.33 112.73 18.9 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.581 ' HB3' ' OD1' ' A' ' 26' ' ' ASN . . . -84.43 89.95 7.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.021 -1.049 . . . . 0.0 109.641 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.687 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -47.11 -22.1 0.32 Allowed 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.814 -0.554 . . . . 0.0 110.903 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.575 ' CD1' ' HB1' ' A' ' 23' ' ' ALA . 4.2 p90 -77.88 -45.18 24.96 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.516 -1.365 . . . . 0.0 111.267 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 23' ' ' ALA . 53.2 p30 -103.64 9.2 37.43 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.366 -1.458 . . . . 0.0 109.721 178.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 57.3 15.07 2.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.607 -0.683 . . . . 0.0 111.245 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -119.07 138.66 52.72 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 120.961 -1.087 . . . . 0.0 109.909 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.491 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 4.3 m -96.2 131.16 42.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.032 -1.042 . . . . 0.0 109.612 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.3 t -117.43 104.15 10.82 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 121.439 -0.788 . . . . 0.0 109.957 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -64.59 153.92 37.83 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.833 -1.167 . . . . 0.0 110.056 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.65 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 94.6 mt-10 -144.12 137.3 27.4 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.363 -0.835 . . . . 0.0 110.177 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.626 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -73.13 85.35 1.35 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.509 ' HB2' ' CD1' ' A' ' 35' ' ' TRP . 17.2 mtpt -128.41 -24.16 3.11 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 119.97 -1.707 . . . . 0.0 108.959 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.642 ' O ' ' N ' ' A' ' 37' ' ' TYR . 5.9 m95 -121.59 -167.66 1.56 Allowed 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.571 ' NZ ' ' NZ ' ' A' ' 11' ' ' LYS . 2.3 mttm 36.05 24.13 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.818 -0.551 . . . . 0.0 110.02 178.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.673 ' O ' ' C ' ' A' ' 38' ' ' LEU . 8.7 t80 -101.04 -27.14 13.43 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.903 -1.123 . . . . 0.0 111.126 -178.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.673 ' C ' ' O ' ' A' ' 37' ' ' TYR . 0.1 OUTLIER 0.34 -119.72 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 121.267 0.556 . . . . 0.0 110.614 -179.429 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -60.43 -44.25 95.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.657 -1.277 . . . . 0.0 109.775 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.807 HG23 ' H ' ' A' ' 41' ' ' GLY . 0.7 OUTLIER -153.89 -97.66 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.915 0 CA-C-O 121.217 0.532 . . . . 0.0 109.806 -179.146 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.807 ' H ' HG23 ' A' ' 40' ' ' THR . . . -106.62 -96.04 2.44 Favored Glycine 0 N--CA 1.494 2.548 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.697 ' HG3' ' O ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER 64.0 107.55 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.132 -1.216 . . . . 0.0 108.703 -179.483 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 O-C-N 120.708 -1.245 . . . . 0.0 109.644 -179.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.513 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 24.7 p . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.58 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -79.36 132.2 11.25 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.319 -1.419 . . . . 0.0 109.673 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.563 ' O ' ' HB2' ' A' ' 31' ' ' CYS . 6.7 p -111.37 -158.62 0.65 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.417 -1.049 . . . . 0.0 108.905 179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' A' ' 3' ' ' SER . 14.1 tttt -37.33 119.83 0.73 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.104 -0.998 . . . . 0.0 109.423 -179.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.411 ' N ' ' OE2' ' A' ' 32' ' ' GLU . 21.1 mtt180 50.74 87.55 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.463 ' HB3' ' N ' ' A' ' 3' ' ' SER . . . -172.23 131.52 0.62 Allowed 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.764 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.4 t90 -44.51 135.73 4.61 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.118 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.6 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -129.98 148.7 51.86 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -95.34 -43.46 8.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.791 -1.193 . . . . 0.0 109.492 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.72 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 14.8 mt-10 -135.67 164.46 27.81 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.317 -0.864 . . . . 0.0 109.076 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.4 ttpt -55.59 -30.58 61.1 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.067 -1.021 . . . . 0.0 109.176 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.04 -8.33 51.76 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.992 -1.067 . . . . 0.0 109.436 179.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.632 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 10.7 t70 -78.73 -3.6 45.07 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.89 -1.131 . . . . 0.0 110.152 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 7.5 m -85.78 141.29 29.78 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 120.623 -1.298 . . . . 0.0 107.958 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 62.3 m -49.03 144.76 4.52 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.165 -0.959 . . . . 0.0 109.702 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.19 136.45 15.21 Favored 'General case' 0 C--O 1.166 -3.309 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.408 ' C ' ' HE1' ' A' ' 35' ' ' TRP . . . 95.82 -1.29 63.36 Favored Glycine 0 N--CA 1.491 2.36 0 C-N-CA 117.397 -2.335 . . . . 0.0 109.663 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -137.76 145.34 42.32 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.078 -1.248 . . . . 0.0 109.682 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.648 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.0 p-10 -103.21 176.43 5.15 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.549 1.166 . . . . 0.0 108.133 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 23.4 m -98.45 128.6 44.88 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 119.999 -1.688 . . . . 0.0 109.983 177.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' ' 30' ' ' SER . 2.2 t -122.16 120.39 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.529 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 9.3 t80 -78.28 120.3 22.85 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.321 -0.862 . . . . 0.0 109.105 -178.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -97.35 108.82 21.63 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.823 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 6.0 p90 -56.26 121.61 9.91 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.128 -0.983 . . . . 0.0 109.57 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.823 ' HB2' ' O ' ' A' ' 24' ' ' TRP . 2.5 t80 157.81 -79.56 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.053 -1.029 . . . . 0.0 109.203 178.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -110.21 22.68 15.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.437 -0.789 . . . . 0.0 109.742 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.529 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 52.0 mm-40 54.9 47.32 22.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.255 -0.903 . . . . 0.0 108.721 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -115.93 131.79 56.84 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.694 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 63.6 m -94.52 122.65 37.32 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.988 -1.07 . . . . 0.0 109.838 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.46 ' O ' ' HB ' ' A' ' 21' ' ' VAL . 30.6 p -97.12 113.99 25.62 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.021 -1.049 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.648 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.6 m -64.52 134.18 53.92 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.826 -1.172 . . . . 0.0 109.464 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.504 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 69.8 mm-40 -142.35 141.81 32.38 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.375 -0.828 . . . . 0.0 110.715 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.755 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.53 43.46 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.023 -1.048 . . . . 0.0 111.012 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 32' ' ' GLU . 12.3 mmtm -50.39 -9.46 0.05 OUTLIER 'General case' 0 C--N 1.292 -1.909 0 O-C-N 120.236 -1.54 . . . . 0.0 110.049 -179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.788 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -122.92 -150.02 0.44 Allowed 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.183 -0.948 . . . . 0.0 110.89 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.788 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 72.5 mttt 112.85 10.37 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 123.449 0.7 . . . . 0.0 110.195 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.465 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -132.54 10.5 4.39 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.638 -1.289 . . . . 0.0 111.117 -179.928 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.923 ' O ' ' N ' ' A' ' 40' ' ' THR . 13.5 tp -170.45 -120.2 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.53 -1.356 . . . . 0.0 110.34 179.062 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.523 ' O ' ' CB ' ' A' ' 40' ' ' THR . 34.6 m-85 32.48 -70.41 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.572 -0.705 . . . . 0.0 110.935 -179.088 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.923 ' N ' ' O ' ' A' ' 38' ' ' LEU . 0.2 OUTLIER 80.65 47.82 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.989 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.385 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.628 ' O ' ' HG2' ' A' ' 42' ' ' GLU . . . -74.1 32.76 0.93 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 110.019 -1.233 . . . . 0.0 110.019 -179.234 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 41' ' ' GLY . 2.0 pt-20 47.73 40.14 11.62 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.836 -0.802 . . . . 0.0 111.14 178.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 94.0 m . . . . . 0 C--N 1.298 -1.652 0 CA-C-O 118.001 -1.0 . . . . 0.0 109.769 179.783 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.524 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 14.7 p . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.11 0.481 . . . . 0.0 110.06 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.491 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -77.42 132.56 12.15 Favored Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.307 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.678 ' O ' ' C ' ' A' ' 4' ' ' LYS . 83.2 p -120.94 148.1 44.54 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.306 -1.114 . . . . 0.0 108.598 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.678 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER 4.77 113.27 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.454 0.645 . . . . 0.0 110.647 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.664 HH11 ' HB3' ' A' ' 5' ' ' ARG . 0.2 OUTLIER 60.22 87.15 0.09 Allowed 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 176.36 133.87 0.05 Allowed 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 110.114 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.781 ' HA ' ' O ' ' A' ' 29' ' ' SER . 24.3 t90 -51.44 130.05 26.58 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.505 0.669 . . . . 0.0 111.282 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.823 ' O ' ' HB2' ' A' ' 29' ' ' SER . 25.3 p -116.26 148.73 40.18 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -92.29 -46.19 7.83 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.408 -1.433 . . . . 0.0 109.123 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.526 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 1.3 mt-10 -154.11 -178.07 6.85 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -60.45 -43.53 96.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.596 -1.315 . . . . 0.0 109.755 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -71.53 -9.76 58.71 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.764 -1.21 . . . . 0.0 110.876 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.526 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.6 OUTLIER -99.46 8.71 44.33 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.921 -1.112 . . . . 0.0 110.078 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.621 ' SG ' ' CB ' ' A' ' 18' ' ' TYR . 16.3 t -101.25 135.11 43.27 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.43 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 0.0 OUTLIER -56.83 145.2 30.3 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.938 -1.101 . . . . 0.0 109.982 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.0 m -49.48 138.14 13.95 Favored 'General case' 1 C--O 1.152 -4.036 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.22 2.08 68.83 Favored Glycine 0 C--N 1.304 -1.243 0 N-CA-C 108.654 -1.778 . . . . 0.0 108.654 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.621 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 90.5 m-85 -137.11 149.39 47.3 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.503 -0.998 . . . . 0.0 110.545 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.897 HD22 ' HB2' ' A' ' 32' ' ' GLU . 1.8 p30 -108.64 163.16 13.49 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.482 -0.762 . . . . 0.0 109.528 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 t -106.21 134.15 49.8 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.228 -0.92 . . . . 0.0 110.033 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 30' ' ' SER . 7.1 p -138.82 141.46 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.145 -0.972 . . . . 0.0 109.701 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -84.41 127.18 33.86 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.061 -1.024 . . . . 0.0 110.508 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -95.6 95.06 8.11 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.442 -0.787 . . . . 0.0 109.434 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.514 ' O ' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -53.49 -40.55 65.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.415 -0.803 . . . . 0.0 110.766 -179.393 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.405 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 51.4 p90 -63.01 -46.37 87.97 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.604 -1.31 . . . . 0.0 110.488 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.462 ' C ' ' H ' ' A' ' 28' ' ' GLN . 12.7 m-20 -92.88 1.53 57.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.86 -1.15 . . . . 0.0 109.23 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 24' ' ' TRP . 99.4 mm-40 56.53 6.3 0.27 Allowed 'General case' 0 C--O 1.158 -3.754 0 CA-C-O 123.998 1.856 . . . . 0.0 111.771 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.745 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 30.1 mt-30 -117.89 154.89 31.11 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 113.623 -1.626 . . . . 0.0 107.875 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.823 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.8 m -91.07 159.54 16.07 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 120.95 -1.094 . . . . 0.0 110.175 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.686 ' O ' HG12 ' A' ' 21' ' ' VAL . 33.2 t -143.03 134.81 26.7 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 121.097 -1.002 . . . . 0.0 110.456 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.649 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 3.4 m -68.89 148.71 49.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.396 -0.815 . . . . 0.0 109.573 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.897 ' HB2' HD22 ' A' ' 19' ' ' ASN . 44.4 mm-40 -141.63 145.65 35.26 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.845 -1.159 . . . . 0.0 111.676 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.65 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -69.76 92.52 0.68 Allowed 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.09 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG3' ' ND2' ' A' ' 19' ' ' ASN . 56.9 mttp -111.24 0.67 16.83 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 120.289 -1.507 . . . . 0.0 108.604 178.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.792 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -119.57 178.35 4.59 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -179.59 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.792 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 5.1 mmtt 103.55 22.64 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.688 ' O ' ' CB ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER -106.51 99.73 9.29 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.33 -0.856 . . . . 0.0 108.716 -179.745 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.688 ' CB ' ' O ' ' A' ' 37' ' ' TYR . 5.3 tp 133.97 -89.12 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 40' ' ' THR . 0.6 OUTLIER 179.41 34.64 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -179.807 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 39' ' ' PHE . 5.4 m -167.94 -118.18 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.205 -0.935 . . . . 0.0 109.332 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 115.15 151.04 9.94 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 108.718 -1.753 . . . . 0.0 108.718 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.479 ' O ' ' OXT' ' A' ' 43' ' ' CYS . 10.3 pt-20 -139.42 157.23 46.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.286 -1.126 . . . . 0.0 110.039 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.479 ' OXT' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 117.993 -1.003 . . . . 0.0 109.623 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 3' ' ' SER . 19.4 p . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 121.231 0.538 . . . . 0.0 109.83 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.498 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -53.86 89.11 0.01 OUTLIER Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.607 ' O ' ' O ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -110.95 104.0 12.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.246 -1.149 . . . . 0.0 109.479 -179.081 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.607 ' O ' ' O ' ' A' ' 3' ' ' SER . 33.5 tttt 49.39 108.96 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.925 0.869 . . . . 0.0 109.205 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.595 ' HG3' ' HG2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 50.78 83.39 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.263 -0.898 . . . . 0.0 108.61 -178.84 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.93 120.54 0.06 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.777 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.8 t90 -48.95 142.35 6.65 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.491 -0.756 . . . . 0.0 111.482 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.462 ' N ' ' CD1' ' A' ' 7' ' ' TRP . 3.0 p -125.64 148.72 48.89 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.464 ' HB3' ' CB ' ' A' ' 13' ' ' ASP . 81.1 tttt -86.01 -28.18 24.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.093 -1.005 . . . . 0.0 108.832 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.776 ' HG3' ' H ' ' A' ' 11' ' ' LYS . 19.2 tp10 -170.28 -157.35 0.15 Allowed 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.776 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 6.3 tmtt? -69.39 -49.03 59.18 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.356 0.598 . . . . 0.0 109.659 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.7 tttm -69.29 -45.56 69.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.441 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.549 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 9.9 t70 -53.83 -9.05 0.2 Allowed 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.463 -0.773 . . . . 0.0 110.535 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.74 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -94.19 150.54 20.22 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.914 -1.116 . . . . 0.0 108.342 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.731 ' O ' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER -60.54 133.77 56.42 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.24 -0.913 . . . . 0.0 110.955 -178.379 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.687 ' N ' ' HB2' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -48.78 66.46 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 CA-C-O 121.533 0.682 . . . . 0.0 110.954 179.482 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.731 ' N ' ' O ' ' A' ' 15' ' ' CYS . . . 179.05 -29.17 0.06 OUTLIER Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.206 -1.958 . . . . 0.0 108.206 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.74 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 94.1 m-85 -108.29 153.75 22.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.707 -0.878 . . . . 0.0 110.19 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.712 ' C ' ' SG ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -101.83 134.09 45.55 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.55 -0.719 . . . . 0.0 109.263 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 43.7 t -80.52 121.51 25.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.985 -1.072 . . . . 0.0 109.938 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.685 HG23 ' OD1' ' A' ' 19' ' ' ASN . 41.4 t -126.55 132.56 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.503 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 62.2 t80 -70.97 131.31 43.5 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.399 178.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.987 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -86.18 81.5 8.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 120.988 -1.07 . . . . 0.0 108.956 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.564 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -54.34 -36.83 64.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.272 -0.892 . . . . 0.0 111.123 -178.934 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.634 ' CE2' ' OD1' ' A' ' 26' ' ' ASN . 51.0 p90 -71.93 -27.08 62.57 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.648 -1.282 . . . . 0.0 110.997 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.861 ' OD1' ' HB1' ' A' ' 23' ' ' ALA . 12.1 p-10 -133.56 13.13 4.11 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.776 -1.202 . . . . 0.0 109.121 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.987 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 79.4 mm-40 63.93 -163.41 0.26 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.436 0.636 . . . . 0.0 110.724 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 59.93 -174.5 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.318 -0.864 . . . . 0.0 109.487 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.777 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 3.2 m -132.67 121.77 23.64 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.235 -0.916 . . . . 0.0 108.856 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -114.62 113.28 24.16 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.218 -0.926 . . . . 0.0 109.966 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.712 ' SG ' ' C ' ' A' ' 19' ' ' ASN . 0.7 OUTLIER -67.01 146.51 54.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.419 -0.913 . . . . 0.0 110.299 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 6.9 pt-20 -142.06 152.31 43.21 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.292 -0.88 . . . . 0.0 109.441 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.559 HH11 ' H ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -50.59 153.08 1.75 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.854 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HB2' ' HB3' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -172.99 65.39 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.295 0 O-C-N 120.779 -1.201 . . . . 0.0 109.611 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.668 ' C ' ' H ' ' A' ' 37' ' ' TYR . 93.5 m95 -122.43 -31.24 3.82 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.156 -0.965 . . . . 0.0 110.195 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.465 ' H ' ' NH1' ' A' ' 33' ' ' ARG . 68.2 mttm 53.4 -9.78 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.615 -0.678 . . . . 0.0 111.145 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.668 ' H ' ' C ' ' A' ' 35' ' ' TRP . 66.3 m-85 -107.3 15.6 24.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.16 -0.963 . . . . 0.0 109.25 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.677 ' O ' ' C ' ' A' ' 39' ' ' PHE . 0.5 OUTLIER 76.01 -47.79 0.57 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.609 -0.682 . . . . 0.0 109.449 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.677 ' C ' ' O ' ' A' ' 38' ' ' LEU . 5.0 t80 -4.84 -93.99 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.734 -0.604 . . . . 0.0 111.078 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.444 HG22 ' CD1' ' A' ' 35' ' ' TRP . 43.6 p 38.39 -151.21 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.465 -0.772 . . . . 0.0 110.707 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.864 ' O ' ' O ' ' A' ' 42' ' ' GLU . . . 92.05 70.33 1.17 Allowed Glycine 0 N--CA 1.495 2.631 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.864 ' O ' ' O ' ' A' ' 41' ' ' GLY . 1.3 pm0 40.42 139.33 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 122.007 -0.702 . . . . 0.0 109.966 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.687 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.301 -1.53 0 O-C-N 120.534 -1.354 . . . . 0.0 108.792 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 15.8 p . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.558 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -76.19 149.84 38.03 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 119.517 -1.325 . . . . 0.0 110.422 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.71 ' O ' ' N ' ' A' ' 5' ' ' ARG . 3.9 m -110.13 -162.57 0.81 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.275 -1.133 . . . . 0.0 109.861 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.779 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 3.6 tttm -58.53 54.23 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.5 -0.75 . . . . 0.0 110.327 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.71 ' N ' ' O ' ' A' ' 3' ' ' SER . 33.7 ptt-85 137.55 76.59 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.662 0.744 . . . . 0.0 109.144 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.416 ' HB3' ' H ' ' A' ' 3' ' ' SER . . . -175.0 146.77 0.89 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.187 -0.946 . . . . 0.0 110.512 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.75 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.1 t90 -47.83 151.11 0.95 Allowed 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.185 0.993 . . . . 0.0 111.746 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER -121.98 153.58 38.35 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.047 -179.597 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -110.8 -29.51 7.94 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.992 -1.067 . . . . 0.0 109.057 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.579 ' HG2' ' H ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -168.79 -173.23 1.8 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.336 -0.852 . . . . 0.0 109.28 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.579 ' H ' ' HG2' ' A' ' 10' ' ' GLU . 6.6 ttmt -66.59 -49.45 66.3 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.199 -0.601 . . . . 0.0 112.187 -178.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -83.95 -10.81 57.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.476 -1.39 . . . . 0.0 109.054 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.496 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 50.3 m-20 -71.78 -3.88 24.58 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.89 179.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.804 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 30.5 t -85.56 149.62 25.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.872 -1.142 . . . . 0.0 108.773 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 64.7 m -57.05 147.65 23.71 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.352 -0.843 . . . . 0.0 109.324 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -52.32 134.15 34.11 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.396 -0.815 . . . . 0.0 109.225 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.464 ' N ' ' HB3' ' A' ' 43' ' ' CYS . . . 94.47 -0.99 66.12 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.625 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 79.7 m-85 -134.17 150.25 51.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.234 -1.156 . . . . 0.0 110.55 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.04 150.82 25.38 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.804 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 2.8 m -94.0 138.27 32.28 Favored 'General case' 0 N--CA 1.403 -2.823 1 O-C-N 116.281 -4.012 . . . . 0.0 109.931 175.494 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.1 t -135.12 137.96 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.447 -0.783 . . . . 0.0 110.824 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.4 103.83 1.39 Allowed 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.696 ' O ' ' C ' ' A' ' 24' ' ' TRP . . . -93.76 -161.74 0.88 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.696 ' C ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER 14.07 94.93 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.95 0.881 . . . . 0.0 109.47 -178.977 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -49.26 3.42 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.68 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.692 ' H ' ' C ' ' A' ' 24' ' ' TRP . 1.1 m120 -81.34 -56.03 4.32 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.277 -0.889 . . . . 0.0 108.824 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.746 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 172.72 37.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.224 1.011 . . . . 0.0 108.652 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.514 ' HB3' ' HB2' ' A' ' 24' ' ' TRP . 56.4 tp60 -121.57 157.38 30.86 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.586 -1.321 . . . . 0.0 110.547 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.75 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 2.6 m -133.32 150.57 51.86 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 t -143.5 136.44 27.65 Favored 'General case' 0 C--N 1.309 -1.185 0 O-C-N 121.078 -1.013 . . . . 0.0 110.529 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 1.5 m -67.09 144.36 56.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.448 -0.783 . . . . 0.0 109.641 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -148.17 139.07 23.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.553 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.739 ' NE ' ' HE1' ' A' ' 35' ' ' TRP . 0.7 OUTLIER -57.94 175.41 0.2 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.121 -0.987 . . . . 0.0 109.384 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.545 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER 178.54 99.36 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.351 0 O-C-N 120.623 -1.298 . . . . 0.0 109.925 179.763 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.739 ' HE1' ' NE ' ' A' ' 33' ' ' ARG . 7.7 p-90 -120.15 167.96 11.71 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.586 -0.696 . . . . 0.0 109.673 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 35' ' ' TRP . 0.3 OUTLIER 80.29 -9.77 1.35 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 -179.149 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.771 ' O ' ' HB2' ' A' ' 38' ' ' LEU . 32.4 p90 -73.21 49.28 0.26 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.382 -0.824 . . . . 0.0 109.377 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.771 ' HB2' ' O ' ' A' ' 37' ' ' TYR . 72.7 mt 96.39 137.04 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.88 43.73 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.591 -0.693 . . . . 0.0 110.031 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.633 ' N ' ' O ' ' A' ' 38' ' ' LEU . 16.1 p -74.77 166.48 23.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.499 -1.376 . . . . 0.0 109.463 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -56.26 -175.05 0.21 Allowed Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -137.46 165.68 25.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -1.097 . . . . 0.0 109.456 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.464 ' HB3' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 O-C-N 121.25 -0.906 . . . . 0.0 109.016 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.564 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 22.0 p . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.645 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -76.6 122.61 6.41 Favored Glycine 0 N--CA 1.486 2.014 0 C-N-CA 118.669 -1.729 . . . . 0.0 108.929 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.697 ' O ' ' C ' ' A' ' 4' ' ' LYS . 14.9 m -98.97 175.21 6.0 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.285 . . . . 0.0 108.148 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.697 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER -25.72 128.38 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.176 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.484 ' HB3' ' O ' ' A' ' 4' ' ' LYS . 14.4 ttp180 60.33 82.19 0.16 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.224 -0.923 . . . . 0.0 109.134 -178.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 176.44 129.02 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.226 -0.921 . . . . 0.0 110.582 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.585 ' HA ' ' O ' ' A' ' 29' ' ' SER . 2.0 t90 -44.66 133.25 6.04 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.572 0.701 . . . . 0.0 110.565 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.713 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 27.6 p -114.12 135.23 54.26 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -90.03 -37.04 14.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.618 -1.301 . . . . 0.0 109.487 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.54 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 0.2 OUTLIER -146.37 177.85 8.7 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.3 -0.875 . . . . 0.0 108.846 178.98 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -61.4 -45.5 94.09 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.328 0.585 . . . . 0.0 110.074 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -81.06 -15.52 55.83 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 119.667 -1.895 . . . . 0.0 112.214 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.54 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -71.81 -7.79 50.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.105 -0.997 . . . . 0.0 111.243 -178.286 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.51 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 51.3 m -88.13 142.79 27.48 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.446 -1.409 . . . . 0.0 107.758 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.503 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -53.09 148.97 7.27 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.542 -178.523 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.617 ' HA ' ' HB3' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -49.17 120.19 3.82 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.134 0.968 . . . . 0.0 109.746 -178.851 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.94 -1.27 35.74 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 4' ' ' LYS . 82.7 m-85 -131.15 144.82 51.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.449 -1.03 . . . . 0.0 108.587 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 9.2 p-10 -118.31 169.08 10.03 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.028 -1.045 . . . . 0.0 110.333 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.1 t -89.45 128.42 35.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.667 -0.645 . . . . 0.0 109.436 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.5 t -127.71 130.74 70.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.367 -0.833 . . . . 0.0 109.459 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -72.79 118.38 15.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.181 -0.949 . . . . 0.0 109.066 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -89.94 95.16 10.1 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.412 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p-90 -52.87 -40.46 63.45 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.523 -0.736 . . . . 0.0 110.517 -178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.642 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.4 OUTLIER -73.9 136.56 43.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.854 -1.154 . . . . 0.0 108.606 179.873 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER 55.95 13.22 1.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.28 -0.888 . . . . 0.0 109.07 -178.389 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 1.3 mp0 50.51 -155.53 0.12 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.408 -0.808 . . . . 0.0 109.888 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.681 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 3.2 tp-100 63.56 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.261 -0.899 . . . . 0.0 110.062 -179.334 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.655 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 70.6 m -100.9 157.03 17.03 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.334 178.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.6 t -136.69 139.06 41.69 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.233 -0.917 . . . . 0.0 110.653 -179.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.713 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 91.3 m -66.87 148.24 52.2 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.494 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 4.6 pt-20 -144.25 139.69 28.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.972 -1.08 . . . . 0.0 108.982 178.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.534 ' NH1' ' NE1' ' A' ' 35' ' ' TRP . 3.9 ttm180 -64.21 155.01 33.15 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.311 -0.868 . . . . 0.0 110.735 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.59 70.88 0.47 Allowed 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.608 ' O ' ' CD1' ' A' ' 35' ' ' TRP . 0.2 OUTLIER -112.36 131.07 55.73 Favored 'General case' 0 C--N 1.289 -2.06 0 CA-C-O 122.321 1.057 . . . . 0.0 110.036 -179.479 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -60.14 -36.08 76.72 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.674 ' CG ' ' O ' ' A' ' 37' ' ' TYR . 42.3 t80 155.89 27.9 0.0 OUTLIER 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 115.192 -0.913 . . . . 0.0 108.632 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.96 HD22 ' N ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -177.97 -175.77 0.51 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.222 -0.924 . . . . 0.0 109.866 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.96 ' N ' HD22 ' A' ' 38' ' ' LEU . 48.4 m-85 -32.1 120.6 0.29 Allowed 'General case' 0 N--CA 1.499 2.021 0 CA-C-O 121.702 0.763 . . . . 0.0 111.528 -178.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.71 34.47 0.39 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.273 -0.892 . . . . 0.0 109.237 178.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 73.91 -134.61 18.96 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.065 -1.614 . . . . 0.0 109.065 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -137.71 154.14 49.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.155 -1.203 . . . . 0.0 109.577 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.617 ' HB3' ' HA ' ' A' ' 16' ' ' CYS . 8.5 p . . . . . 0 C--N 1.303 -1.444 0 CA-C-O 118.008 -0.996 . . . . 0.0 109.618 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.733 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.674 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -73.57 150.17 42.9 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.464 ' O ' ' C ' ' A' ' 4' ' ' LYS . 50.2 m -105.26 -170.2 1.71 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.355 -1.085 . . . . 0.0 109.505 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.464 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.6 OUTLIER -37.52 121.84 0.89 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.219 -0.925 . . . . 0.0 109.91 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.612 ' N ' ' O ' ' A' ' 31' ' ' CYS . 42.5 ttp180 48.89 86.05 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 178.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.476 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -173.03 124.23 0.42 Allowed 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 121.975 0.893 . . . . 0.0 109.668 -178.394 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.714 ' HA ' ' O ' ' A' ' 29' ' ' SER . 34.7 t90 -24.54 142.67 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.21 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.678 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -130.95 157.08 43.91 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.731 0.777 . . . . 0.0 110.574 179.379 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 30.5 mttm -88.49 -40.82 13.16 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 177.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.52 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 51.1 mm-40 -159.41 -173.65 4.28 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 121.541 0.686 . . . . 0.0 109.173 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.584 ' HG3' ' OD1' ' A' ' 19' ' ' ASN . 53.5 tttm -67.94 -45.82 73.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.363 -0.836 . . . . 0.0 109.986 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -12.83 60.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.529 -0.732 . . . . 0.0 110.099 -178.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.52 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 12.4 m-20 -85.4 2.58 43.82 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.045 -1.034 . . . . 0.0 111.549 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 3.8 m -85.38 143.38 28.67 Favored 'General case' 0 C--N 1.308 -1.237 0 O-C-N 120.428 -1.42 . . . . 0.0 108.408 179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.733 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 11.0 m -54.56 138.92 39.69 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.323 -0.861 . . . . 0.0 108.708 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 44.4 t -34.12 148.49 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.509 ' CA ' ' HB3' ' A' ' 43' ' ' CYS . . . 74.94 1.38 62.53 Favored Glycine 0 N--CA 1.493 2.44 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.706 ' HB3' ' HB3' ' A' ' 31' ' ' CYS . 62.8 m-85 -135.93 156.57 48.57 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.5 -1.589 . . . . 0.0 111.157 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 1.055 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 32.1 t30 -131.05 169.24 16.13 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.727 . . . . 0.0 110.391 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 6.3 t -90.35 109.08 20.2 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.915 -1.116 . . . . 0.0 109.94 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.679 HG21 ' CD ' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -103.58 134.22 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.493 -0.754 . . . . 0.0 109.797 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.536 ' CD2' ' O ' ' A' ' 23' ' ' ALA . 65.4 t80 -67.91 141.49 56.35 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.044 -1.035 . . . . 0.0 108.966 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -85.52 -148.82 0.12 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.299 -0.876 . . . . 0.0 110.01 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.416 ' CZ3' ' O ' ' A' ' 22' ' ' TYR . 0.8 OUTLIER -175.01 -49.0 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.253 -179.336 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.429 ' CE1' ' OD1' ' A' ' 26' ' ' ASN . 4.2 p90 -86.78 -34.29 19.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.61 -1.307 . . . . 0.0 108.375 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.429 ' OD1' ' CE1' ' A' ' 25' ' ' TYR . 20.1 p-10 -109.57 10.34 25.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.478 -0.764 . . . . 0.0 109.361 178.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.57 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 98.6 mm-40 54.59 -167.22 0.08 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.101 -0.999 . . . . 0.0 110.77 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 64.06 -168.36 0.21 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.537 -0.727 . . . . 0.0 109.274 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.714 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 58.9 m -131.84 147.15 52.46 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.365 -0.834 . . . . 0.0 109.441 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.8 p -128.37 143.11 50.96 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 1.055 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 77.7 m -67.63 148.08 51.85 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.006 -1.059 . . . . 0.0 109.874 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.679 ' CD ' HG21 ' A' ' 21' ' ' VAL . 0.7 OUTLIER -147.71 149.7 32.93 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.117 -0.989 . . . . 0.0 110.275 179.463 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -59.79 135.51 57.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.625 -1.297 . . . . 0.0 109.26 -179.11 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -87.35 0.72 55.02 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.241 -0.912 . . . . 0.0 111.877 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.611 ' O ' ' HG2' ' A' ' 36' ' ' LYS . 5.4 m95 54.26 -167.97 0.07 Allowed 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 -177.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 35' ' ' TRP . 50.0 mmtt -164.81 -41.12 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.884 -1.135 . . . . 0.0 108.977 177.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.563 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 59.0 t80 173.66 -21.14 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.205 179.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -164.55 -158.35 0.41 Allowed 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.217 -0.927 . . . . 0.0 110.32 -179.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -55.79 -44.13 77.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.233 -0.917 . . . . 0.0 109.893 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.403 HG22 ' N ' ' A' ' 41' ' ' GLY . 88.8 m -71.47 155.67 40.32 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 121.335 -0.853 . . . . 0.0 108.779 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.403 ' N ' HG22 ' A' ' 40' ' ' THR . . . 134.72 17.3 0.95 Allowed Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.491 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -95.47 126.01 40.47 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.151 -1.205 . . . . 0.0 108.708 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.509 ' HB3' ' CA ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.599 -179.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.649 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 121.171 0.51 . . . . 0.0 109.689 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.573 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -59.51 -89.99 0.02 OUTLIER Glycine 0 N--CA 1.494 2.513 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.287 -178.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 1.3 t 87.13 -173.78 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.683 -0.893 . . . . 0.0 110.54 -178.402 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.597 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 71.5 tttt -43.66 126.64 4.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.569 -0.707 . . . . 0.0 109.842 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.597 ' HG2' ' HG2' ' A' ' 4' ' ' LYS . 0.4 OUTLIER 46.92 81.26 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -177.669 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.81 126.78 0.1 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.242 -177.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.81 ' HA ' ' O ' ' A' ' 29' ' ' SER . 31.8 t90 -52.77 137.74 30.85 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.662 0.744 . . . . 0.0 111.692 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.707 ' SG ' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -122.03 170.98 9.3 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.478 178.405 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.707 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -121.98 -36.8 2.94 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.521 -1.362 . . . . 0.0 108.041 177.871 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.728 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 44.6 mt-10 -148.36 169.51 20.0 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 tptm -59.05 -23.77 62.28 Favored 'General case' 0 C--N 1.292 -1.893 0 O-C-N 121.076 -1.015 . . . . 0.0 108.72 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -93.33 -33.98 13.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.612 -0.68 . . . . 0.0 111.282 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.472 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -63.74 -6.98 6.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.006 -1.059 . . . . 0.0 110.58 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.745 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.4 t -93.96 160.77 14.58 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.497 -0.752 . . . . 0.0 108.998 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.649 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 94.1 m -56.78 140.0 49.14 Favored 'General case' 0 C--N 1.306 -1.312 0 O-C-N 120.985 -1.072 . . . . 0.0 109.108 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.43 129.31 41.24 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.508 ' O ' ' CD1' ' A' ' 35' ' ' TRP . . . 104.0 -4.14 45.26 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.93 ' C ' ' HE1' ' A' ' 35' ' ' TRP . 95.3 m-85 -117.99 141.18 48.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.942 -1.328 . . . . 0.0 109.32 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.835 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 5.3 p-10 -90.91 144.03 26.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.323 -0.86 . . . . 0.0 108.739 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.728 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 18.0 m -90.31 136.29 33.14 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.576 0.703 . . . . 0.0 111.253 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 29' ' ' SER . 41.9 t -117.25 101.48 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -73.85 114.46 12.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.338 -0.851 . . . . 0.0 109.42 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -94.93 88.81 5.4 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.279 -0.888 . . . . 0.0 110.506 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.621 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -51.86 -2.05 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.384 -0.823 . . . . 0.0 109.941 178.489 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.588 ' H ' ' C ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -60.37 -49.31 78.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.083 -1.011 . . . . 0.0 109.637 -179.047 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.405 ' OD1' ' HB3' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -151.27 46.75 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.234 -0.916 . . . . 0.0 109.286 179.464 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 52.28 37.95 23.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.466 -0.771 . . . . 0.0 110.165 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.783 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 44.3 tt0 -120.36 114.14 21.4 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.21 -0.931 . . . . 0.0 109.513 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.81 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.7 m -95.24 172.37 8.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.948 -1.095 . . . . 0.0 109.277 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 20' ' ' CYS . 1.6 t -144.56 -157.81 0.82 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.236 -0.915 . . . . 0.0 109.849 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.835 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -165.73 138.49 4.21 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.018 -179.729 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -145.2 144.25 30.74 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.71 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 1.1 ptp85 -57.57 110.27 0.85 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.151 -0.968 . . . . 0.0 111.45 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -155.12 56.3 0.65 Allowed 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 178.143 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.93 ' HE1' ' C ' ' A' ' 18' ' ' TYR . 39.9 m95 -114.01 -13.05 12.53 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.577 -0.702 . . . . 0.0 111.347 -178.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.445 ' C ' ' O ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER 42.01 9.87 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.214 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.741 ' N ' ' O ' ' A' ' 35' ' ' TRP . 67.5 m-85 -106.47 47.7 0.87 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.957 -1.09 . . . . 0.0 109.042 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.24 -33.24 74.21 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.504 -0.748 . . . . 0.0 109.215 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -53.99 -45.3 71.39 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.451 -0.78 . . . . 0.0 109.089 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.506 HG22 ' H ' ' A' ' 42' ' ' GLU . 14.6 m -76.39 161.42 28.7 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -117.39 10.18 14.78 Favored Glycine 0 N--CA 1.499 2.838 0 C-N-CA 119.843 -1.17 . . . . 0.0 110.719 -179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.506 ' H ' HG22 ' A' ' 40' ' ' THR . 13.4 pt-20 -138.08 -177.78 4.98 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.948 -1.325 . . . . 0.0 109.321 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.302 -1.499 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.289 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.503 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 19.4 p . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.626 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -88.41 114.7 4.27 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.41 -1.376 . . . . 0.0 109.892 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 4' ' ' LYS . 3.6 m -94.31 -159.52 0.71 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.142 -1.211 . . . . 0.0 107.736 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 11.6 tmtt? -46.9 147.54 1.31 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.426 -1.421 . . . . 0.0 108.286 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 5' ' ' ARG . 8.1 ptm180 39.2 78.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.563 1.173 . . . . 0.0 109.286 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.71 125.96 0.08 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.442 -0.787 . . . . 0.0 109.266 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' SER . 72.5 t90 -45.06 134.1 6.19 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.578 0.704 . . . . 0.0 111.729 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -123.83 136.03 54.13 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.858 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HB3' ' CG ' ' A' ' 13' ' ' ASP . 31.0 tttm -82.73 -40.87 19.97 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.656 ' HG2' ' N ' ' A' ' 11' ' ' LYS . 62.8 tt0 -156.55 179.58 9.12 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.276 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.656 ' N ' ' HG2' ' A' ' 10' ' ' GLU . 1.6 ttpm? -58.87 -43.96 90.96 Favored 'General case' 0 C--N 1.285 -2.214 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.874 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -69.63 -37.79 76.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.358 -0.839 . . . . 0.0 110.582 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.474 ' CG ' ' HB3' ' A' ' 9' ' ' LYS . 10.3 t70 -60.34 -23.47 64.27 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.779 -1.201 . . . . 0.0 110.577 -178.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.3 t -79.56 142.96 35.24 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.024 -1.048 . . . . 0.0 108.833 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -51.47 121.95 7.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.835 0.826 . . . . 0.0 109.429 -177.759 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' CYS . 1.3 t -38.1 137.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.274 0.559 . . . . 0.0 109.523 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.614 ' N ' ' SG ' ' A' ' 43' ' ' CYS . . . 100.79 -14.24 58.96 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 67.7 m-85 -111.23 150.47 29.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.994 -1.298 . . . . 0.0 110.312 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.628 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.9 t30 -97.46 132.24 43.35 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.442 -0.787 . . . . 0.0 109.93 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.724 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 5.3 m -85.94 143.01 28.41 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.276 -0.89 . . . . 0.0 109.863 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 30' ' ' SER . 0.3 OUTLIER -134.61 143.57 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.625 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -109.94 111.78 23.38 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 108.717 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.636 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -89.64 93.36 9.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.914 -1.116 . . . . 0.0 109.264 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -54.23 -38.14 65.4 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.403 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.611 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -60.37 -46.65 89.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.947 -1.096 . . . . 0.0 108.931 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.401 ' C ' ' H ' ' A' ' 28' ' ' GLN . 81.1 m-20 -92.45 -6.75 49.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.191 -0.943 . . . . 0.0 108.8 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.636 ' N ' ' O ' ' A' ' 23' ' ' ALA . 0.1 OUTLIER 58.72 6.48 0.62 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.432 -0.793 . . . . 0.0 109.474 -179.831 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.401 ' H ' ' C ' ' A' ' 26' ' ' ASN . 29.1 mm100 -109.99 137.19 48.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.346 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.694 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.4 m -93.82 144.5 25.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.083 -1.011 . . . . 0.0 108.427 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.477 ' O ' HG12 ' A' ' 21' ' ' VAL . 13.6 p -142.93 127.98 18.51 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.372 -0.83 . . . . 0.0 109.776 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -69.85 160.45 31.77 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.342 -0.849 . . . . 0.0 110.545 -179.945 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -145.18 141.28 28.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.541 -0.724 . . . . 0.0 109.057 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.455 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -70.19 128.94 37.99 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.594 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 94.5 mttt -158.2 27.13 0.25 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 120.856 -1.152 . . . . 0.0 109.855 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.454 ' C ' ' N ' ' A' ' 37' ' ' TYR . 88.9 m95 -116.86 -1.43 12.02 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.291 -0.88 . . . . 0.0 109.752 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.25 -10.92 0.09 Allowed 'General case' 0 C--N 1.296 -1.718 0 O-C-N 121.75 -0.594 . . . . 0.0 109.814 -178.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.454 ' N ' ' C ' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -112.73 41.49 2.04 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.991 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.485 HD22 ' HA ' ' A' ' 38' ' ' LEU . 0.2 OUTLIER -145.62 153.7 41.33 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.184 -0.947 . . . . 0.0 108.682 179.724 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.529 ' O ' ' C ' ' A' ' 40' ' ' THR . 44.3 t80 -46.34 114.44 0.8 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.132 -0.98 . . . . 0.0 108.981 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.529 ' C ' ' O ' ' A' ' 39' ' ' PHE . 9.9 m 31.8 -117.43 0.05 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.323 0.583 . . . . 0.0 110.173 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.543 ' C ' ' HG2' ' A' ' 42' ' ' GLU . . . -159.31 -29.65 0.02 OUTLIER Glycine 0 N--CA 1.485 1.948 0 C-N-CA 119.97 -1.11 . . . . 0.0 110.348 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.543 ' HG2' ' C ' ' A' ' 41' ' ' GLY . 1.6 pm0 35.54 67.7 0.26 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.243 -1.151 . . . . 0.0 108.912 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.614 ' SG ' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER . . . . . 0 C--N 1.301 -1.519 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.355 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.543 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 25.5 p . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.99 129.94 9.82 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 4' ' ' LYS . 29.6 m -99.28 -170.48 1.92 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -1.114 . . . . 0.0 108.541 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' A' ' 3' ' ' SER . 48.4 tttm -46.87 128.73 11.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.555 -1.341 . . . . 0.0 107.565 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 62.09 79.36 0.26 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.361 -0.935 . . . . 0.0 108.635 -178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.55 129.97 0.1 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.246 -0.908 . . . . 0.0 109.927 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.795 ' HA ' ' O ' ' A' ' 29' ' ' SER . 45.4 t90 -53.27 138.47 32.16 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.424 0.63 . . . . 0.0 111.961 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.557 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -122.2 160.68 24.68 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.505 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.497 ' N ' ' OD2' ' A' ' 13' ' ' ASP . 18.3 tttt -85.78 -45.83 11.24 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.285 -0.884 . . . . 0.0 109.202 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.597 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 93.1 mt-10 -145.19 -167.34 2.65 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.661 0.744 . . . . 0.0 109.263 -179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 tptt -62.67 -40.92 98.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.829 -0.545 . . . . 0.0 110.253 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -87.52 -3.07 59.0 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.112 -0.993 . . . . 0.0 110.761 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.597 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 24.8 t70 -80.93 -3.6 52.04 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.874 -1.141 . . . . 0.0 111.951 -177.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 34.2 m -86.09 145.08 27.2 Favored 'General case' 0 C--N 1.308 -1.233 0 O-C-N 120.298 -1.501 . . . . 0.0 108.862 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.543 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 72.5 m -51.39 161.67 0.43 Allowed 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 -179.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -58.33 137.55 57.11 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.41 4.3 87.98 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -130.95 141.53 50.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -1.205 . . . . 0.0 110.414 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 31.3 p-10 -104.36 166.91 10.09 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.936 -1.102 . . . . 0.0 109.181 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 18.8 t -102.81 130.69 49.88 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.239 -0.913 . . . . 0.0 109.569 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.05 128.55 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -79.3 123.75 27.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.082 -1.012 . . . . 0.0 109.121 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.578 ' HB1' ' CE2' ' A' ' 25' ' ' TYR . . . -101.57 74.2 1.5 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.285 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.1 p-90 -54.55 -36.06 63.91 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.094 -1.004 . . . . 0.0 109.786 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.578 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -56.64 -26.07 55.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.0 109.361 -179.723 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.557 ' ND2' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -141.73 28.85 1.75 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.947 . . . . 0.0 108.897 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 23' ' ' ALA . 5.9 mp0 48.89 -171.0 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.523 -0.736 . . . . 0.0 109.23 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.46 ' O ' ' O ' ' A' ' 27' ' ' GLN . 4.0 mm-40 57.87 153.93 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.36 -0.838 . . . . 0.0 110.196 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.795 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 40.4 m -114.69 132.76 56.3 Favored 'General case' 1 C--O 1.148 -4.243 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.328 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.7 p -107.91 127.09 53.44 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.591 0.71 . . . . 0.0 110.75 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 79.9 m -71.66 148.92 46.03 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.443 -0.786 . . . . 0.0 110.263 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.501 ' O ' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -147.02 149.56 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.73 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.616 ' O ' ' CB ' ' A' ' 34' ' ' LYS . 10.4 ptt180 -51.93 -165.24 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.055 -1.028 . . . . 0.0 111.66 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.616 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 91.7 mttt . . . . . 0 N--CA 1.498 1.971 0 C-N-CA 123.592 0.757 . . . . 0.0 109.807 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.513 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 28.8 p . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.637 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -73.29 118.45 6.27 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 108.19 -1.964 . . . . 0.0 108.19 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.7 m -99.02 -161.21 0.86 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.306 . . . . 0.0 109.056 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -53.14 125.06 16.18 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 6' ' ' ALA . 96.2 mtt-85 56.46 86.82 0.06 Allowed 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 178.52 135.25 0.08 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.771 0.796 . . . . 0.0 109.955 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' SER . 40.7 t90 -50.54 143.57 9.06 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.603 0.716 . . . . 0.0 111.061 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.63 148.37 46.51 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -95.24 -32.04 13.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.918 -1.114 . . . . 0.0 109.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 78.4 mm-40 -154.65 177.92 10.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.354 -0.841 . . . . 0.0 108.885 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -60.35 -48.86 79.94 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.42 ' C ' ' H ' ' A' ' 14' ' ' CYS . 16.4 ttmm -76.47 -35.03 58.66 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.741 -0.6 . . . . 0.0 111.128 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.49 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 7.8 m-20 -59.87 -1.3 0.27 Allowed 'General case' 0 N--CA 1.482 1.14 0 O-C-N 121.004 -1.06 . . . . 0.0 110.618 -178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.692 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 47.9 t -90.58 147.68 23.18 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.021 -1.049 . . . . 0.0 108.753 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.513 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -58.1 139.83 53.94 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.217 -0.927 . . . . 0.0 109.677 -179.328 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 126.22 21.41 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.831 -0.747 . . . . 0.0 109.024 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.62 -6.78 24.33 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.692 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 86.0 m-85 -128.69 143.75 51.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.307 -1.114 . . . . 0.0 110.792 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.542 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 65.5 t30 -102.9 145.84 29.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.494 -0.754 . . . . 0.0 109.123 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.4 t -86.95 128.92 35.06 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.031 -1.043 . . . . 0.0 109.143 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 88.3 t -128.6 136.38 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.568 -0.707 . . . . 0.0 110.061 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -66.63 140.41 57.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.409 -0.807 . . . . 0.0 109.305 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 1.045 ' HB1' HD21 ' A' ' 26' ' ' ASN . . . -87.2 -142.58 0.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.519 -0.738 . . . . 0.0 110.27 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.518 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 8.9 p90 -172.22 -42.15 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.991 -0.683 . . . . 0.0 111.188 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.518 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -100.01 11.03 40.3 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.41 -1.432 . . . . 0.0 110.078 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 1.068 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -140.42 2.41 1.85 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.448 -0.783 . . . . 0.0 109.127 178.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.3 mm-40 46.79 34.21 2.49 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.089 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -122.57 -167.79 1.63 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.51 -0.744 . . . . 0.0 109.276 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.705 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.2 m -127.86 123.41 35.02 Favored 'General case' 0 C--O 1.181 -2.54 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 p -112.8 120.01 39.99 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.194 -0.941 . . . . 0.0 110.143 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -67.39 143.61 56.22 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.716 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -148.02 134.56 19.77 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.6 110.8 1.82 Allowed 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.401 ' HG2' ' H ' ' A' ' 34' ' ' LYS . 46.5 pttt . . . . . 0 C--N 1.305 -1.365 0 O-C-N 120.973 -1.08 . . . . 0.0 111.286 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.488 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 26.2 p . . . . . 0 N--CA 1.489 1.485 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.51 138.39 28.83 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 108.694 -1.762 . . . . 0.0 108.694 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.541 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 26.1 t -100.7 -138.63 0.33 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.281 -1.129 . . . . 0.0 108.701 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.541 ' N ' ' OG ' ' A' ' 3' ' ' SER . 12.7 tmtt? -61.39 128.43 36.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.675 -1.265 . . . . 0.0 107.745 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.682 ' N ' ' O ' ' A' ' 31' ' ' CYS . 45.0 ptt85 41.76 90.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 122.578 1.18 . . . . 0.0 108.92 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -169.59 139.15 2.0 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-O 122.039 0.923 . . . . 0.0 109.377 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.729 ' HE1' ' HZ2' ' A' ' 9' ' ' LYS . 0.6 OUTLIER -47.07 131.63 12.42 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.713 0.768 . . . . 0.0 112.217 -177.603 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.587 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -121.09 152.32 38.82 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 177.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.729 ' HZ2' ' HE1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -98.6 -28.37 13.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.897 -1.127 . . . . 0.0 109.058 178.618 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.648 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 24.5 mt-10 -145.33 179.2 7.55 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-O 121.761 0.791 . . . . 0.0 109.825 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -61.26 -47.61 85.23 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.443 -0.786 . . . . 0.0 109.003 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 14' ' ' CYS . 85.1 tttt -83.56 -22.35 32.38 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.397 -0.815 . . . . 0.0 109.898 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.648 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 14.7 t70 -47.33 -11.88 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.019 -1.05 . . . . 0.0 109.882 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.547 ' N ' ' O ' ' A' ' 12' ' ' LYS . 59.9 m -83.25 133.57 34.99 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.475 ' C ' ' O ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -42.07 145.99 0.32 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.358 -0.839 . . . . 0.0 109.378 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -49.67 125.42 11.51 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.557 -0.714 . . . . 0.0 109.209 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.01 0.25 41.6 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -129.84 141.95 50.75 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.609 -0.936 . . . . 0.0 109.501 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.699 ' ND2' ' O ' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -103.56 158.89 16.05 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.212 -0.93 . . . . 0.0 109.24 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 39.1 t -92.37 112.67 24.7 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.763 -1.211 . . . . 0.0 110.031 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.49 ' O ' ' CB ' ' A' ' 29' ' ' SER . 75.5 t -89.28 132.07 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -81.02 124.53 29.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.245 -0.91 . . . . 0.0 109.292 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.781 ' HB1' ' CE2' ' A' ' 25' ' ' TYR . . . -114.03 118.63 34.64 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.949 0.88 . . . . 0.0 110.55 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.584 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -54.29 -11.95 0.58 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.781 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 34.7 p90 -94.75 129.92 41.49 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.371 -1.456 . . . . 0.0 110.102 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.604 ' O ' ' C ' ' A' ' 27' ' ' GLN . 68.1 m-20 55.14 34.16 22.02 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.478 -0.764 . . . . 0.0 109.446 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.604 ' C ' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 29.44 43.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 122.261 1.029 . . . . 0.0 108.592 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.59 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 1.2 tm0? -111.36 163.62 13.79 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.667 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 14.6 m -125.8 148.33 49.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.185 -0.947 . . . . 0.0 110.473 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -108.44 117.21 33.57 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.63 -0.669 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.682 ' O ' ' N ' ' A' ' 5' ' ' ARG . 96.6 m -65.74 130.55 43.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.955 -1.091 . . . . 0.0 109.131 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.699 ' O ' ' ND2' ' A' ' 19' ' ' ASN . 95.5 mt-10 -146.98 135.09 21.54 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.966 -1.084 . . . . 0.0 110.639 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -74.92 107.45 7.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.402 -0.811 . . . . 0.0 110.183 178.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HG3' HD21 ' A' ' 19' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 O-C-N 120.563 -1.336 . . . . 0.0 111.461 178.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.547 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.4 p . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.01 141.15 35.53 Favored Glycine 0 N--CA 1.487 2.098 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.6 m -108.09 -152.96 0.49 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.378 -1.072 . . . . 0.0 109.207 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.07 118.83 4.35 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.098 -1.001 . . . . 0.0 108.588 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.543 ' HE ' ' CA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 53.96 91.55 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 122.087 0.946 . . . . 0.0 108.555 -178.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -175.77 125.7 0.22 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.844 0.83 . . . . 0.0 109.092 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.648 ' HA ' ' O ' ' A' ' 29' ' ' SER . 1.9 t90 -40.15 138.31 0.87 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.611 0.719 . . . . 0.0 110.856 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -111.57 140.28 46.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.6 tttm -86.71 -37.68 17.7 Favored 'General case' 0 C--N 1.294 -1.814 0 O-C-N 121.415 -0.803 . . . . 0.0 109.09 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.64 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 28.2 mt-10 -151.26 162.77 40.3 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.519 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -57.55 -32.64 67.31 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.104 -0.997 . . . . 0.0 108.611 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.421 ' HD2' ' HZ2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -87.5 -4.63 58.99 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.065 -1.022 . . . . 0.0 109.57 178.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.544 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -92.64 5.15 52.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.811 -1.181 . . . . 0.0 111.651 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.776 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 16.5 m -88.39 140.2 29.71 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.268 -1.52 . . . . 0.0 107.665 178.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 73.6 m -51.11 146.81 5.96 Favored 'General case' 0 N--CA 1.502 2.132 0 C-N-CA 117.078 -1.849 . . . . 0.0 110.407 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -52.01 118.63 3.59 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 121.195 -0.94 . . . . 0.0 110.259 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.05 -14.45 11.16 Favored Glycine 1 N--CA 1.534 5.167 0 C-N-CA 119.214 -1.47 . . . . 0.0 109.748 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -125.86 144.69 50.56 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.33 -1.1 . . . . 0.0 109.156 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.605 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 p-10 -108.64 175.73 5.36 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.039 -1.038 . . . . 0.0 109.404 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.64 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 1.6 m -90.5 135.84 33.44 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.851 -1.156 . . . . 0.0 110.472 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.63 100.56 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -67.32 126.14 28.32 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.12 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -89.15 100.83 13.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.275 -0.89 . . . . 0.0 108.931 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.486 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -50.17 -27.65 6.19 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 108.869 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.456 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -99.41 149.5 23.12 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.496 ' OD1' ' O ' ' A' ' 26' ' ' ASN . 1.1 p30 51.29 12.47 0.14 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.968 -1.082 . . . . 0.0 108.852 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.503 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 97.1 mm-40 43.94 -148.81 0.06 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.512 -0.742 . . . . 0.0 109.119 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 27' ' ' GLN . 98.6 mt-30 60.39 134.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.264 -0.897 . . . . 0.0 110.214 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.648 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 34.2 m -96.89 170.47 9.14 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.456 -0.778 . . . . 0.0 109.537 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -141.21 129.69 22.56 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.321 -0.862 . . . . 0.0 109.431 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 96.5 m -72.27 131.27 42.47 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.615 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.409 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 1.0 OUTLIER -150.05 128.41 12.14 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.152 -0.968 . . . . 0.0 109.979 179.471 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.499 ' C ' ' CD ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.69 146.57 54.55 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.445 -0.784 . . . . 0.0 109.647 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HE3' HD21 ' A' ' 19' ' ' ASN . 42.1 mttt . . . . . 0 N--CA 1.485 1.278 0 O-C-N 121.248 -0.908 . . . . 0.0 110.48 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.582 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.6 p . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 7' ' ' TRP . . . -63.02 120.12 20.01 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.562 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 10.9 t -96.69 -163.49 1.05 Allowed 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.181 -1.188 . . . . 0.0 108.744 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.562 ' N ' ' OG ' ' A' ' 3' ' ' SER . 15.7 tttp -45.47 121.59 3.09 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.187 -0.946 . . . . 0.0 108.604 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 56.66 86.89 0.06 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.15 152.43 1.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.337 -0.852 . . . . 0.0 110.865 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.64 ' HA ' ' O ' ' A' ' 29' ' ' SER . 20.2 t90 -53.7 154.19 3.95 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.905 0.859 . . . . 0.0 112.213 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.645 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -132.11 136.01 46.83 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -87.95 -46.94 8.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.589 -1.319 . . . . 0.0 107.547 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.783 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 95.7 mt-10 -141.38 178.41 7.45 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.466 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.1 tttt -58.38 -45.98 87.25 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.516 -0.874 . . . . 0.0 109.432 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' NZ ' ' CB ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.04 -34.33 71.17 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.198 -0.939 . . . . 0.0 110.44 179.351 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.602 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 3.4 t70 -52.91 -6.76 0.06 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.292 -0.88 . . . . 0.0 112.045 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.711 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 12.7 m -86.47 146.46 26.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 120.404 -1.435 . . . . 0.0 108.904 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.582 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 71.0 m -52.87 137.05 33.07 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -46.03 122.97 4.19 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.396 -0.815 . . . . 0.0 109.753 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.61 -8.07 24.15 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -125.52 142.52 51.46 Favored 'General case' 0 C--O 1.286 2.989 0 O-C-N 121.092 -1.24 . . . . 0.0 111.829 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.495 ' ND2' ' N ' ' A' ' 20' ' ' CYS . 2.8 t30 -100.12 163.2 12.52 Favored 'General case' 0 N--CA 1.499 2.007 1 O-C-N 116.067 -4.145 . . . . 0.0 108.952 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.783 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 24.8 m -90.19 130.71 36.3 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 120.488 -1.382 . . . . 0.0 109.849 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 30' ' ' SER . 0.3 OUTLIER -133.84 159.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.589 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.438 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 57.2 t80 -102.99 127.47 50.21 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.187 -0.946 . . . . 0.0 110.137 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -93.49 113.0 25.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.161 -0.962 . . . . 0.0 109.257 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.1 p-90 -53.89 1.73 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.323 -0.861 . . . . 0.0 110.74 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.585 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 36.2 p90 -123.91 148.24 47.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.991 -1.068 . . . . 0.0 109.224 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 54.51 17.22 1.55 Allowed 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.516 ' C ' ' O ' ' A' ' 26' ' ' ASN . 53.7 mm-40 24.94 65.08 0.05 Allowed 'General case' 0 N--CA 1.5 2.048 0 CA-C-O 121.12 0.486 . . . . 0.0 111.459 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.568 ' HB3' HD21 ' A' ' 26' ' ' ASN . 41.8 tt0 -132.42 155.68 48.06 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.232 -0.917 . . . . 0.0 109.742 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.64 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.4 m -90.17 118.64 29.85 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.411 ' O ' HG12 ' A' ' 21' ' ' VAL . 27.3 t -103.98 124.24 48.65 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 120.963 -1.086 . . . . 0.0 111.184 -178.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 88.4 m -67.48 119.24 11.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.134 -0.978 . . . . 0.0 109.316 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.474 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 1.9 pt-20 -144.5 121.31 11.25 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -70.93 167.05 19.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.683 -1.261 . . . . 0.0 110.194 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.307 -1.26 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.528 ' HB2' ' CA ' ' A' ' 15' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -81.03 132.69 11.4 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.475 ' O ' ' C ' ' A' ' 4' ' ' LYS . 21.7 m -104.45 -162.45 0.89 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.357 -1.084 . . . . 0.0 108.675 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.475 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.9 OUTLIER -44.25 130.93 6.3 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.649 -1.282 . . . . 0.0 108.096 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 mtp85 54.37 82.51 0.09 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.989 -1.069 . . . . 0.0 108.713 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 125.62 0.24 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.996 -1.065 . . . . 0.0 110.514 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.542 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.1 t90 -49.07 131.32 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.419 0.628 . . . . 0.0 111.078 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.525 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -117.87 153.17 33.99 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 178.26 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.72 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 6.8 tmtt? -94.77 -25.19 16.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.03 . . . . 0.0 108.718 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.539 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 5.9 pt-20 -165.65 -171.82 2.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.408 -0.807 . . . . 0.0 109.277 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.42 -45.25 94.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.301 -0.874 . . . . 0.0 109.229 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.9 tptp -70.39 -25.26 63.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.327 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.72 ' CG ' ' H ' ' A' ' 9' ' ' LYS . 11.5 t70 -63.75 -17.62 63.22 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.274 -0.891 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.1 m -83.57 122.17 28.2 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 119.943 -1.723 . . . . 0.0 107.961 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.537 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.99 -173.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 122.132 0.967 . . . . 0.0 111.418 -177.81 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.537 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.5 OUTLIER 22.08 -143.23 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.722 177.281 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -89.45 29.94 5.92 Favored Glycine 0 C--N 1.284 -2.348 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.602 ' CD1' ' HB2' ' A' ' 33' ' ' ARG . 91.4 m-85 -82.83 135.41 34.96 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.534 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 17.3 p-10 -99.07 149.0 23.46 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.951 -1.093 . . . . 0.0 109.391 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 15.2 t -90.89 126.27 36.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.148 -0.97 . . . . 0.0 110.152 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 66.7 t -120.25 130.95 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.486 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 14.5 t80 -78.12 122.41 25.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.906 -1.121 . . . . 0.0 109.025 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' TYR . . . -98.38 88.66 4.2 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -7.67 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.099 -1.001 . . . . 0.0 109.469 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.4 m-85 -58.47 -46.69 86.1 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.082 -1.011 . . . . 0.0 109.864 -179.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.632 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -147.98 45.63 1.08 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.05 -1.031 . . . . 0.0 109.797 -179.597 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.486 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 96.6 mm-40 44.12 42.84 5.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.225 -0.922 . . . . 0.0 109.025 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -120.93 138.42 54.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.737 -0.602 . . . . 0.0 109.691 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.542 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 0.7 OUTLIER -95.62 112.95 24.56 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.293 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.0 t -98.52 114.98 27.59 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.042 -1.036 . . . . 0.0 110.831 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 18' ' ' TYR . 89.0 m -67.89 145.22 54.8 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.262 -0.898 . . . . 0.0 109.183 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.534 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 97.8 mt-10 -146.46 107.45 4.16 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.987 -1.071 . . . . 0.0 112.077 -178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.602 ' HB2' ' CD1' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -79.14 131.84 36.35 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.613 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt . . . . . 0 C--N 1.297 -1.69 0 O-C-N 120.699 -1.25 . . . . 0.0 108.44 178.916 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.786 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 11.0 p . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.068 0.461 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.56 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -66.14 -51.07 47.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.542 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 2.6 t 86.33 -169.2 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.471 0.653 . . . . 0.0 110.298 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 24.4 tttm -52.36 128.63 26.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.345 -0.847 . . . . 0.0 109.366 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttm-85 49.18 84.2 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.56 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.12 139.53 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.809 -0.757 . . . . 0.0 110.46 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.877 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.3 t90 -43.69 127.02 4.84 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.511 0.672 . . . . 0.0 110.878 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.54 ' O ' ' HB2' ' A' ' 29' ' ' SER . 22.0 p -123.98 133.61 53.65 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -91.82 -44.73 8.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.405 -1.434 . . . . 0.0 109.139 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.441 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 18.6 mt-10 -149.72 178.45 8.86 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -61.03 -47.61 85.64 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.59 -0.694 . . . . 0.0 109.989 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.26 -38.16 78.27 Favored 'General case' 0 C--N 1.292 -1.926 0 O-C-N 120.307 -1.495 . . . . 0.0 112.564 178.764 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.441 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 97.2 m-20 -66.98 -10.83 53.78 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.144 -0.972 . . . . 0.0 109.888 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.522 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 22.9 t -91.97 150.95 20.73 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.825 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.786 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.7 OUTLIER -61.89 135.88 57.75 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.38 143.25 6.68 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.761 -1.212 . . . . 0.0 109.039 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.19 -3.64 69.85 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.522 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 48.2 m-85 -125.92 141.28 52.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.297 -1.12 . . . . 0.0 111.284 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.53 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 12.5 p-10 -98.42 144.12 28.13 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 t -88.43 136.31 33.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.555 -0.716 . . . . 0.0 109.691 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.426 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 72.4 t -123.13 131.27 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -102.8 122.64 44.91 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.114 -0.991 . . . . 0.0 108.351 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB1' ' CE1' ' A' ' 25' ' ' TYR . . . -89.34 115.3 26.7 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.752 -1.218 . . . . 0.0 109.498 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.406 ' CD1' ' CD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -50.49 -27.19 6.12 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.623 -0.673 . . . . 0.0 110.06 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.956 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.1 p90 -99.23 164.5 12.11 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.003 -1.061 . . . . 0.0 110.175 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.956 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 45.78 13.6 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 CA-C-O 121.143 0.497 . . . . 0.0 110.339 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 25' ' ' TYR . 95.3 mm-40 34.0 46.3 0.14 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.616 -0.677 . . . . 0.0 111.04 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.701 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 tp60 -120.23 127.07 52.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.256 -0.903 . . . . 0.0 109.29 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.877 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.5 m -101.42 150.86 22.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.552 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 27.7 t -149.32 129.43 13.58 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.626 -1.296 . . . . 0.0 111.091 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.5 OUTLIER -73.22 159.95 32.67 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.289 -0.882 . . . . 0.0 111.453 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -146.09 159.03 43.85 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.323 -0.86 . . . . 0.0 110.142 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.583 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -60.76 132.48 54.02 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.699 0.761 . . . . 0.0 111.878 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 5.8 mmmt . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 120.919 0.39 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.614 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -52.98 122.6 21.23 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 108.926 -1.67 . . . . 0.0 108.926 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 14.7 t -102.23 -166.36 1.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -1.119 . . . . 0.0 109.466 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.499 ' N ' ' OG ' ' A' ' 3' ' ' SER . 0.5 OUTLIER -39.86 116.52 0.65 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.956 -1.09 . . . . 0.0 109.243 -179.406 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 5' ' ' ARG . 9.6 ttm180 59.97 86.32 0.1 Allowed 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.656 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.61 137.18 0.2 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.104 -0.997 . . . . 0.0 110.436 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.751 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.4 t90 -45.97 136.44 6.54 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.479 0.657 . . . . 0.0 111.94 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.993 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 2.4 p -134.11 152.29 51.77 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.655 -0.653 . . . . 0.0 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.449 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 11.7 mtmt -93.03 -49.26 6.1 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.769 -1.207 . . . . 0.0 108.289 178.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.616 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 34.2 mp0 -138.27 178.7 6.93 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.479 ' HB2' ' HZ2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -60.9 -43.58 98.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.793 -1.192 . . . . 0.0 108.187 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -65.89 -23.09 66.57 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.673 -0.642 . . . . 0.0 109.556 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.616 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 35.0 t70 -67.59 -16.09 63.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.157 -0.965 . . . . 0.0 110.701 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 83.5 m -84.81 127.33 34.08 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 120.789 -1.194 . . . . 0.0 108.128 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.568 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -57.69 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.774 0.797 . . . . 0.0 110.906 -178.452 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 13.0 t 19.6 -139.73 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 122.411 1.1 . . . . 0.0 111.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.532 ' N ' ' SG ' ' A' ' 16' ' ' CYS . . . -97.66 33.34 5.95 Favored Glycine 0 C--N 1.287 -2.177 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.467 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 78.3 m-85 -89.61 142.77 27.37 Favored 'General case' 0 C--N 1.288 -2.077 0 O-C-N 121.792 -0.828 . . . . 0.0 109.67 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -101.49 153.64 19.53 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.394 -0.816 . . . . 0.0 110.446 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.0 t -89.8 139.07 30.94 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.242 -0.911 . . . . 0.0 109.153 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -128.61 163.99 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.417 -0.802 . . . . 0.0 109.064 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.522 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 74.9 t80 -113.85 132.15 56.0 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.274 -0.891 . . . . 0.0 110.544 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -109.55 132.64 53.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.74 . . . . 0.0 110.02 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.424 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -56.9 -46.34 82.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.6 -0.688 . . . . 0.0 111.407 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.424 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -72.92 140.58 47.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.726 -1.233 . . . . 0.0 110.329 -178.226 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.658 ' O ' ' C ' ' A' ' 27' ' ' GLN . 18.9 m120 56.82 25.41 10.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.759 -0.588 . . . . 0.0 110.235 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.658 ' C ' ' O ' ' A' ' 26' ' ' ASN . 50.6 mm-40 21.78 49.25 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.607 ' N ' ' O ' ' A' ' 26' ' ' ASN . 8.8 tt0 -115.57 141.68 47.74 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.393 -0.817 . . . . 0.0 110.248 -178.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.751 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.0 m -92.7 142.85 26.9 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -129.58 133.22 47.06 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.267 -0.896 . . . . 0.0 110.858 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.993 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 99.2 m -70.77 144.07 50.99 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.43 -0.794 . . . . 0.0 110.808 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -151.31 135.52 16.76 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 4.2 tmm_? -58.77 143.55 46.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.22 -0.925 . . . . 0.0 110.285 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.505 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.284 0 O-C-N 121.511 -0.743 . . . . 0.0 110.025 178.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.734 ' HA ' ' O ' ' A' ' 13' ' ' ASP . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.394 0.616 . . . . 0.0 109.969 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.2 150.77 51.99 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 108.336 -1.906 . . . . 0.0 108.336 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . 8.1 t -95.41 -178.07 4.31 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.136 -1.214 . . . . 0.0 108.921 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.728 ' NZ ' HH21 ' A' ' 33' ' ' ARG . 31.7 tttp -47.76 120.84 3.62 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.553 ' HE ' HH22 ' A' ' 33' ' ' ARG . 9.5 mmt85 58.77 86.21 0.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.502 ' O ' ' N ' ' A' ' 31' ' ' CYS . . . -177.5 147.1 0.49 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.281 -0.887 . . . . 0.0 110.757 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.913 ' HA ' ' O ' ' A' ' 29' ' ' SER . 58.9 t90 -39.2 135.4 0.99 Allowed 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.944 0.878 . . . . 0.0 112.165 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.959 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 17.9 p -132.02 157.98 42.71 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.26 -42.54 8.49 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.727 -1.233 . . . . 0.0 108.896 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 2.5 pt-20 -158.21 -170.23 3.05 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -61.52 -43.31 99.09 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.604 -0.685 . . . . 0.0 111.602 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -85.84 -19.43 30.65 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.683 -1.261 . . . . 0.0 112.09 -177.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.734 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 1.1 m-20 -73.15 -0.53 14.42 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 120.507 -1.371 . . . . 0.0 110.793 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 20.6 m -90.58 144.29 25.91 Favored 'General case' 0 C--N 1.308 -1.205 0 O-C-N 120.492 -1.38 . . . . 0.0 109.221 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.564 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.06 125.1 19.06 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.382 -0.823 . . . . 0.0 109.494 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.564 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -28.15 130.3 0.06 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.257 0.551 . . . . 0.0 109.975 -179.672 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 103.02 -13.54 55.96 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -125.85 146.89 49.62 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.09 -1.241 . . . . 0.0 110.68 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.742 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 3.4 t30 -97.57 -166.86 1.44 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.8 t -138.12 130.54 29.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.424 -0.797 . . . . 0.0 109.044 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.3 t -139.38 154.95 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.367 -0.833 . . . . 0.0 110.137 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -75.39 126.36 30.86 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.516 -0.74 . . . . 0.0 109.618 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -105.08 109.68 21.77 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.286 -0.884 . . . . 0.0 110.574 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.468 ' C ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p90 -57.39 -9.5 1.07 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.285 -0.884 . . . . 0.0 111.238 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.437 ' HB3' ' ND2' ' A' ' 26' ' ' ASN . 15.4 t80 -59.78 -47.97 83.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.744 -1.223 . . . . 0.0 110.231 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.57 ' N ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -146.46 51.86 1.12 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.548 -1.345 . . . . 0.0 109.168 178.324 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.468 ' H ' ' NE2' ' A' ' 27' ' ' GLN . 26.5 mm-40 40.94 31.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.543 -0.723 . . . . 0.0 109.329 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.562 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -119.16 149.75 41.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -179.829 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.913 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.1 m -89.03 160.19 17.21 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.173 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 8.6 t -139.25 134.76 33.1 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.961 -1.087 . . . . 0.0 110.659 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.959 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 94.6 m -70.4 133.94 47.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.163 -0.961 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -150.22 144.45 25.63 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.807 -1.183 . . . . 0.0 110.353 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.728 HH21 ' NZ ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -56.52 163.21 1.85 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.483 -0.761 . . . . 0.0 110.444 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.308 -1.238 0 O-C-N 120.796 -1.19 . . . . 0.0 110.594 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.3 p . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.521 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -75.65 131.76 12.39 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 108.685 -1.766 . . . . 0.0 108.685 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 91.9 p -103.57 -145.23 0.37 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -1.081 . . . . 0.0 109.471 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -51.65 120.55 5.31 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.051 -1.031 . . . . 0.0 109.001 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.41 88.16 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.232 -0.918 . . . . 0.0 108.625 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 134.75 0.31 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.717 0.77 . . . . 0.0 109.939 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.88 ' HA ' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -44.74 148.79 0.48 Allowed 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.984 0.897 . . . . 0.0 111.929 -179.099 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.684 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -125.34 153.59 43.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.068 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 87.1 tttt -85.56 -33.69 21.66 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 7.3 mm-40 -164.54 -173.04 2.89 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-O 121.492 0.663 . . . . 0.0 109.632 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -62.79 -48.67 78.13 Favored 'General case' 0 C--O 1.184 -2.351 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.57 ' HZ2' ' CB ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -87.17 2.75 48.96 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 118.471 -1.292 . . . . 0.0 109.528 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.569 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 49.0 m-20 -93.29 4.24 54.31 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.678 -0.639 . . . . 0.0 111.97 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.684 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 1.3 m -84.57 155.94 21.85 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 120.297 -1.502 . . . . 0.0 107.167 179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 2' ' ' GLY . 89.0 m -47.2 166.75 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.916 -1.115 . . . . 0.0 109.215 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.61 130.45 44.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.198 -0.939 . . . . 0.0 110.106 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 83.77 8.04 85.0 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 32' ' ' GLU . 61.4 m-85 -119.3 148.03 43.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.101 -1.235 . . . . 0.0 110.888 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.2 t30 -118.71 157.23 27.87 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.445 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 16.0 t -91.22 132.47 36.09 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.934 -1.103 . . . . 0.0 110.739 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -121.33 131.79 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.62 126.1 26.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.123 -0.985 . . . . 0.0 108.907 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -112.74 108.87 18.05 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.432 -0.793 . . . . 0.0 109.513 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.52 ' CG ' ' N ' ' A' ' 25' ' ' TYR . 5.9 p-90 -53.92 -39.16 65.6 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.102 -0.998 . . . . 0.0 109.324 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' N ' ' CG ' ' A' ' 24' ' ' TRP . 11.5 p90 -71.5 141.57 50.16 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.327 -0.949 . . . . 0.0 108.904 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.456 ' OD1' ' OE1' ' A' ' 28' ' ' GLN . 1.0 OUTLIER 70.22 -4.68 1.49 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.433 ' H ' ' C ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER 57.62 16.93 3.68 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.777 -0.824 . . . . 0.0 108.777 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.555 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 98.6 mt-30 -113.59 -172.06 2.01 Favored 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.548 -1.345 . . . . 0.0 108.55 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.88 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 50.1 m -121.01 138.43 54.17 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -103.31 139.8 38.26 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 121.424 -0.798 . . . . 0.0 111.234 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 87.9 m -70.92 152.0 44.11 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.377 -0.827 . . . . 0.0 109.653 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -147.57 -156.82 0.75 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.555 ' N ' ' OE1' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -156.85 126.73 6.3 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 122.316 1.055 . . . . 0.0 108.793 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt . . . . . 0 C--N 1.306 -1.293 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -178.361 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.479 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.442 0.639 . . . . 0.0 109.78 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.489 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -68.43 -51.23 32.9 Favored Glycine 0 N--CA 1.495 2.594 0 O-C-N 121.382 -0.824 . . . . 0.0 113.436 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.544 ' O ' ' C ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER 80.61 172.62 0.13 Allowed 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.075 -1.25 . . . . 0.0 110.244 -178.203 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.986 ' NZ ' ' HE ' ' A' ' 33' ' ' ARG . 46.4 tttp -28.77 129.56 0.07 Allowed 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.15 -0.969 . . . . 0.0 110.426 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 49.19 78.76 0.09 Allowed 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 3' ' ' SER . . . -171.39 135.87 0.97 Allowed 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.324 -1.35 . . . . 0.0 111.138 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.644 ' HA ' ' O ' ' A' ' 29' ' ' SER . 23.3 t90 -51.43 136.42 25.64 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.651 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.586 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -123.22 147.85 46.46 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 178.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.58 ' HB3' ' OD2' ' A' ' 13' ' ' ASP . 16.0 ttpt -88.94 -46.96 8.49 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.915 -1.115 . . . . 0.0 108.486 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.425 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 1.5 mm-40 -142.93 -179.36 6.31 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.483 ' CE ' ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -61.61 -36.05 79.6 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.678 -1.264 . . . . 0.0 110.181 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -80.72 -8.55 59.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.031 -1.043 . . . . 0.0 109.993 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.58 ' OD2' ' HB3' ' A' ' 9' ' ' LYS . 24.3 t0 -85.01 0.22 52.18 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.813 -1.179 . . . . 0.0 110.894 -179.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 5.3 m -88.64 142.87 27.33 Favored 'General case' 0 C--N 1.309 -1.193 0 O-C-N 120.121 -1.612 . . . . 0.0 108.028 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 3' ' ' SER . 34.6 m -47.87 140.57 6.53 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.342 -0.849 . . . . 0.0 108.888 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.56 137.13 15.74 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.112 -0.993 . . . . 0.0 109.716 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.44 -0.73 78.18 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -124.83 144.95 50.02 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.29 -1.124 . . . . 0.0 110.063 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.519 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 t30 -100.24 153.61 19.13 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.473 -0.767 . . . . 0.0 110.127 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 41.9 t -91.15 114.58 27.15 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.537 0.684 . . . . 0.0 109.245 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -97.06 142.84 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.605 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -103.12 127.13 50.51 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.191 -0.943 . . . . 0.0 109.533 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.14 100.94 13.46 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.203 -0.936 . . . . 0.0 109.36 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.502 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 1.0 OUTLIER -44.14 -27.35 0.39 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.411 -0.806 . . . . 0.0 110.099 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' C ' ' H ' ' A' ' 27' ' ' GLN . 5.9 p90 -98.71 146.34 25.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.957 -1.089 . . . . 0.0 108.16 179.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 27' ' ' GLN . 1.1 m120 61.03 -3.43 0.16 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.359 -0.838 . . . . 0.0 109.348 -179.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.52 ' H ' ' C ' ' A' ' 25' ' ' TYR . 3.2 mp0 45.46 50.99 9.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.177 -0.952 . . . . 0.0 109.025 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.79 132.88 56.51 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.644 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 13.8 m -96.11 124.39 40.1 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.989 -1.069 . . . . 0.0 110.926 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.432 ' H ' HG12 ' A' ' 21' ' ' VAL . 1.2 p -105.5 118.67 37.15 Favored 'General case' 0 C--N 1.31 -1.147 0 O-C-N 121.273 -0.892 . . . . 0.0 109.792 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.7 m -65.72 142.87 57.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.741 -1.224 . . . . 0.0 108.923 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -142.49 139.71 31.61 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.982 -1.074 . . . . 0.0 110.548 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.986 ' HE ' ' NZ ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -63.97 60.31 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.858 -0.526 . . . . 0.0 112.152 179.779 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.414 ' N ' ' O ' ' A' ' 32' ' ' GLU . 1.1 mmmp? . . . . . 0 N--CA 1.492 1.658 0 O-C-N 120.236 -1.54 . . . . 0.0 110.627 179.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.673 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.615 ' O ' ' HB3' ' A' ' 3' ' ' SER . . . -69.04 -59.19 6.06 Favored Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.925 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 2' ' ' GLY . 33.6 t 84.74 -165.28 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.785 -0.832 . . . . 0.0 110.549 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 68.6 tttt -51.64 132.2 30.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.626 -0.671 . . . . 0.0 109.318 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 53.37 78.6 0.14 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HB1' ' CA ' ' A' ' 2' ' ' GLY . . . -178.09 129.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.985 -1.072 . . . . 0.0 110.78 -178.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.491 ' HA ' ' O ' ' A' ' 29' ' ' SER . 38.4 t90 -52.78 117.52 2.99 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.511 -0.743 . . . . 0.0 110.219 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.648 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -109.32 150.66 27.68 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.731 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -92.5 -35.02 13.84 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.511 -1.368 . . . . 0.0 109.423 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.648 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -159.22 -170.16 2.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 109.029 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.7 tptm -60.64 -48.52 81.4 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.903 -1.123 . . . . 0.0 109.43 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -69.84 -41.99 74.19 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.542 -0.724 . . . . 0.0 111.678 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HB3' ' H ' ' A' ' 10' ' ' GLU . 14.4 t70 -54.29 -14.78 1.28 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.796 -1.19 . . . . 0.0 110.429 -178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.659 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 48.5 t -88.95 146.12 25.1 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.029 -1.044 . . . . 0.0 108.851 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.673 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.6 m -54.53 134.82 46.51 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.213 -178.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 123.96 16.23 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.25 -7.22 10.67 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.715 -1.754 . . . . 0.0 108.715 -179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.659 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 97.5 m-85 -125.38 150.98 46.73 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -1.067 . . . . 0.0 110.807 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.65 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 9.3 p-10 -96.57 133.1 41.48 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.0 t -93.4 125.93 38.26 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.354 -0.841 . . . . 0.0 109.763 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 21' ' ' VAL . 3.2 p -119.54 114.12 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -81.33 112.73 18.9 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.771 ' HB3' HD21 ' A' ' 26' ' ' ASN . . . -84.43 89.95 7.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.021 -1.049 . . . . 0.0 109.641 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.687 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -47.11 -22.1 0.32 Allowed 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.814 -0.554 . . . . 0.0 110.903 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.575 ' CD1' ' HB1' ' A' ' 23' ' ' ALA . 4.2 p90 -77.88 -45.18 24.96 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.516 -1.365 . . . . 0.0 111.267 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.991 ' ND2' ' H ' ' A' ' 28' ' ' GLN . 0.1 OUTLIER -103.64 9.2 37.43 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.366 -1.458 . . . . 0.0 109.721 178.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.616 ' N ' HD22 ' A' ' 26' ' ' ASN . 99.0 mm-40 57.3 15.07 2.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.607 -0.683 . . . . 0.0 111.245 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.991 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 77.4 mt-30 -119.07 138.66 52.72 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 120.961 -1.087 . . . . 0.0 109.909 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.491 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 4.3 m -96.2 131.16 42.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.032 -1.042 . . . . 0.0 109.612 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.3 t -117.43 104.15 10.82 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 121.439 -0.788 . . . . 0.0 109.957 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -64.59 153.92 37.83 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.833 -1.167 . . . . 0.0 110.056 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.65 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 94.6 mt-10 -144.12 137.3 27.4 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.363 -0.835 . . . . 0.0 110.177 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.626 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -73.13 85.35 1.35 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.2 mtpt . . . . . 0 N--CA 1.488 1.467 0 O-C-N 119.97 -1.707 . . . . 0.0 108.959 178.453 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.513 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 24.7 p . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.58 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -79.36 132.2 11.25 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.319 -1.419 . . . . 0.0 109.673 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.563 ' O ' ' HB2' ' A' ' 31' ' ' CYS . 6.7 p -111.37 -158.62 0.65 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.417 -1.049 . . . . 0.0 108.905 179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' A' ' 3' ' ' SER . 14.1 tttt -37.33 119.83 0.73 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.104 -0.998 . . . . 0.0 109.423 -179.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.411 ' N ' ' OE2' ' A' ' 32' ' ' GLU . 21.1 mtt180 50.74 87.55 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.463 ' HB3' ' N ' ' A' ' 3' ' ' SER . . . -172.23 131.52 0.62 Allowed 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.764 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.4 t90 -44.51 135.73 4.61 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.118 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.6 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -129.98 148.7 51.86 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -95.34 -43.46 8.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.791 -1.193 . . . . 0.0 109.492 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.72 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 14.8 mt-10 -135.67 164.46 27.81 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.317 -0.864 . . . . 0.0 109.076 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.4 ttpt -55.59 -30.58 61.1 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.067 -1.021 . . . . 0.0 109.176 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.04 -8.33 51.76 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.992 -1.067 . . . . 0.0 109.436 179.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.632 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 10.7 t70 -78.73 -3.6 45.07 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.89 -1.131 . . . . 0.0 110.152 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 7.5 m -85.78 141.29 29.78 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 120.623 -1.298 . . . . 0.0 107.958 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 62.3 m -49.03 144.76 4.52 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.165 -0.959 . . . . 0.0 109.702 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.19 136.45 15.21 Favored 'General case' 0 C--O 1.166 -3.309 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 95.82 -1.29 63.36 Favored Glycine 0 N--CA 1.491 2.36 0 C-N-CA 117.397 -2.335 . . . . 0.0 109.663 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -137.76 145.34 42.32 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.078 -1.248 . . . . 0.0 109.682 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.648 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.0 p-10 -103.21 176.43 5.15 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.549 1.166 . . . . 0.0 108.133 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 23.4 m -98.45 128.6 44.88 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 119.999 -1.688 . . . . 0.0 109.983 177.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' ' 30' ' ' SER . 2.2 t -122.16 120.39 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.529 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 9.3 t80 -78.28 120.3 22.85 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.321 -0.862 . . . . 0.0 109.105 -178.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -97.35 108.82 21.63 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.823 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 6.0 p90 -56.26 121.61 9.91 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.128 -0.983 . . . . 0.0 109.57 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.823 ' HB2' ' O ' ' A' ' 24' ' ' TRP . 2.5 t80 157.81 -79.56 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.053 -1.029 . . . . 0.0 109.203 178.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -110.21 22.68 15.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.437 -0.789 . . . . 0.0 109.742 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.529 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 52.0 mm-40 54.9 47.32 22.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.255 -0.903 . . . . 0.0 108.721 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -115.93 131.79 56.84 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.694 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 63.6 m -94.52 122.65 37.32 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.988 -1.07 . . . . 0.0 109.838 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.46 ' O ' ' HB ' ' A' ' 21' ' ' VAL . 30.6 p -97.12 113.99 25.62 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.021 -1.049 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.648 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.6 m -64.52 134.18 53.92 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.826 -1.172 . . . . 0.0 109.464 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.504 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 69.8 mm-40 -142.35 141.81 32.38 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.375 -0.828 . . . . 0.0 110.715 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.755 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.53 43.46 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.023 -1.048 . . . . 0.0 111.012 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 32' ' ' GLU . 12.3 mmtm . . . . . 0 C--N 1.292 -1.909 0 O-C-N 120.236 -1.54 . . . . 0.0 110.049 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.524 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 14.7 p . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.11 0.481 . . . . 0.0 110.06 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.491 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -77.42 132.56 12.15 Favored Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.678 ' O ' ' C ' ' A' ' 4' ' ' LYS . 83.2 p -120.94 148.1 44.54 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.306 -1.114 . . . . 0.0 108.598 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.678 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER 4.77 113.27 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.454 0.645 . . . . 0.0 110.647 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.664 HH11 ' HB3' ' A' ' 5' ' ' ARG . 0.2 OUTLIER 60.22 87.15 0.09 Allowed 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 176.36 133.87 0.05 Allowed 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 110.114 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.781 ' HA ' ' O ' ' A' ' 29' ' ' SER . 24.3 t90 -51.44 130.05 26.58 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.505 0.669 . . . . 0.0 111.282 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.823 ' O ' ' HB2' ' A' ' 29' ' ' SER . 25.3 p -116.26 148.73 40.18 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -92.29 -46.19 7.83 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.408 -1.433 . . . . 0.0 109.123 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.526 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 1.3 mt-10 -154.11 -178.07 6.85 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -60.45 -43.53 96.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.596 -1.315 . . . . 0.0 109.755 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -71.53 -9.76 58.71 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.764 -1.21 . . . . 0.0 110.876 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.526 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.6 OUTLIER -99.46 8.71 44.33 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.921 -1.112 . . . . 0.0 110.078 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.621 ' SG ' ' CB ' ' A' ' 18' ' ' TYR . 16.3 t -101.25 135.11 43.27 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.43 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 0.0 OUTLIER -56.83 145.2 30.3 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.938 -1.101 . . . . 0.0 109.982 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.0 m -49.48 138.14 13.95 Favored 'General case' 1 C--O 1.152 -4.036 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.22 2.08 68.83 Favored Glycine 0 C--N 1.304 -1.243 0 N-CA-C 108.654 -1.778 . . . . 0.0 108.654 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.621 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 90.5 m-85 -137.11 149.39 47.3 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.503 -0.998 . . . . 0.0 110.545 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.649 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.5 p-10 -108.64 163.16 13.49 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.482 -0.762 . . . . 0.0 109.528 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 t -106.21 134.15 49.8 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.228 -0.92 . . . . 0.0 110.033 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 30' ' ' SER . 7.1 p -138.82 141.46 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.145 -0.972 . . . . 0.0 109.701 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -84.41 127.18 33.86 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.061 -1.024 . . . . 0.0 110.508 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -95.6 95.06 8.11 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.442 -0.787 . . . . 0.0 109.434 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.514 ' O ' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -53.49 -40.55 65.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.415 -0.803 . . . . 0.0 110.766 -179.393 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.405 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 51.4 p90 -63.01 -46.37 87.97 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.604 -1.31 . . . . 0.0 110.488 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.462 ' C ' ' H ' ' A' ' 28' ' ' GLN . 12.7 m-20 -92.88 1.53 57.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.86 -1.15 . . . . 0.0 109.23 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 24' ' ' TRP . 99.4 mm-40 56.53 6.3 0.27 Allowed 'General case' 0 C--O 1.158 -3.754 0 CA-C-O 123.998 1.856 . . . . 0.0 111.771 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.745 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 30.1 mt-30 -117.89 154.89 31.11 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 113.623 -1.626 . . . . 0.0 107.875 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.823 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.8 m -91.07 159.54 16.07 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 120.95 -1.094 . . . . 0.0 110.175 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.686 ' O ' HG12 ' A' ' 21' ' ' VAL . 33.2 t -143.03 134.81 26.7 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 121.097 -1.002 . . . . 0.0 110.456 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.649 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 3.4 m -68.89 148.71 49.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.396 -0.815 . . . . 0.0 109.573 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.479 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 44.4 mm-40 -141.63 145.65 35.26 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.845 -1.159 . . . . 0.0 111.676 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.65 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -69.76 92.52 0.68 Allowed 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.09 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 56.9 mttp . . . . . 0 C--N 1.304 -1.382 0 O-C-N 120.289 -1.507 . . . . 0.0 108.604 178.738 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 3' ' ' SER . 19.4 p . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 121.231 0.538 . . . . 0.0 109.83 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.498 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -53.86 89.11 0.01 OUTLIER Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.607 ' O ' ' O ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -110.95 104.0 12.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.246 -1.149 . . . . 0.0 109.479 -179.081 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.607 ' O ' ' O ' ' A' ' 3' ' ' SER . 33.5 tttt 49.39 108.96 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.925 0.869 . . . . 0.0 109.205 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.595 ' HG3' ' HG2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 50.78 83.39 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.263 -0.898 . . . . 0.0 108.61 -178.84 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.93 120.54 0.06 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.777 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.8 t90 -48.95 142.35 6.65 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.491 -0.756 . . . . 0.0 111.482 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.462 ' N ' ' CD1' ' A' ' 7' ' ' TRP . 3.0 p -125.64 148.72 48.89 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.464 ' HB3' ' CB ' ' A' ' 13' ' ' ASP . 81.1 tttt -86.01 -28.18 24.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.093 -1.005 . . . . 0.0 108.832 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.776 ' HG3' ' H ' ' A' ' 11' ' ' LYS . 19.2 tp10 -170.28 -157.35 0.15 Allowed 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.776 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 6.3 tmtt? -69.39 -49.03 59.18 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.356 0.598 . . . . 0.0 109.659 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.7 tttm -69.29 -45.56 69.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.441 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.549 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 9.9 t70 -53.83 -9.05 0.2 Allowed 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.463 -0.773 . . . . 0.0 110.535 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.74 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -94.19 150.54 20.22 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.914 -1.116 . . . . 0.0 108.342 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.731 ' O ' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER -60.54 133.77 56.42 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.24 -0.913 . . . . 0.0 110.955 -178.379 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -48.78 66.46 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 CA-C-O 121.533 0.682 . . . . 0.0 110.954 179.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.731 ' N ' ' O ' ' A' ' 15' ' ' CYS . . . 179.05 -29.17 0.06 OUTLIER Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.206 -1.958 . . . . 0.0 108.206 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.74 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 94.1 m-85 -108.29 153.75 22.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.707 -0.878 . . . . 0.0 110.19 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.712 ' C ' ' SG ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -101.83 134.09 45.55 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.55 -0.719 . . . . 0.0 109.263 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 43.7 t -80.52 121.51 25.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.985 -1.072 . . . . 0.0 109.938 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.685 HG23 ' OD1' ' A' ' 19' ' ' ASN . 41.4 t -126.55 132.56 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.503 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 62.2 t80 -70.97 131.31 43.5 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.399 178.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 1.001 ' HB1' ' ND2' ' A' ' 26' ' ' ASN . . . -86.18 81.5 8.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 120.988 -1.07 . . . . 0.0 108.956 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.564 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -54.34 -36.83 64.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.272 -0.892 . . . . 0.0 111.123 -178.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.781 ' CE2' ' ND2' ' A' ' 26' ' ' ASN . 51.0 p90 -71.93 -27.08 62.57 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.648 -1.282 . . . . 0.0 110.997 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 1.001 ' ND2' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.56 13.13 4.11 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.776 -1.202 . . . . 0.0 109.121 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.987 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 79.4 mm-40 63.93 -163.41 0.26 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.436 0.636 . . . . 0.0 110.724 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 59.93 -174.5 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.318 -0.864 . . . . 0.0 109.487 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.777 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 3.2 m -132.67 121.77 23.64 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.235 -0.916 . . . . 0.0 108.856 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -114.62 113.28 24.16 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.218 -0.926 . . . . 0.0 109.966 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.712 ' SG ' ' C ' ' A' ' 19' ' ' ASN . 0.7 OUTLIER -67.01 146.51 54.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.419 -0.913 . . . . 0.0 110.299 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 6.9 pt-20 -142.06 152.31 43.21 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.292 -0.88 . . . . 0.0 109.441 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -50.59 153.08 1.75 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.854 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HB2' ' HB3' ' A' ' 19' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.306 -1.295 0 O-C-N 120.779 -1.201 . . . . 0.0 109.611 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 15.8 p . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.558 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -76.19 149.84 38.03 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 119.517 -1.325 . . . . 0.0 110.422 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.71 ' O ' ' N ' ' A' ' 5' ' ' ARG . 3.9 m -110.13 -162.57 0.81 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.275 -1.133 . . . . 0.0 109.861 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.779 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 3.6 tttm -58.53 54.23 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.5 -0.75 . . . . 0.0 110.327 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.71 ' N ' ' O ' ' A' ' 3' ' ' SER . 33.7 ptt-85 137.55 76.59 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.662 0.744 . . . . 0.0 109.144 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.416 ' HB3' ' H ' ' A' ' 3' ' ' SER . . . -175.0 146.77 0.89 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.187 -0.946 . . . . 0.0 110.512 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.75 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.1 t90 -47.83 151.11 0.95 Allowed 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.185 0.993 . . . . 0.0 111.746 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER -121.98 153.58 38.35 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.047 -179.597 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -110.8 -29.51 7.94 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.992 -1.067 . . . . 0.0 109.057 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.579 ' HG2' ' H ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -168.79 -173.23 1.8 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.336 -0.852 . . . . 0.0 109.28 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.579 ' H ' ' HG2' ' A' ' 10' ' ' GLU . 6.6 ttmt -66.59 -49.45 66.3 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.199 -0.601 . . . . 0.0 112.187 -178.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -83.95 -10.81 57.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.476 -1.39 . . . . 0.0 109.054 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.496 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 50.3 m-20 -71.78 -3.88 24.58 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.89 179.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.804 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 30.5 t -85.56 149.62 25.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.872 -1.142 . . . . 0.0 108.773 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 64.7 m -57.05 147.65 23.71 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.352 -0.843 . . . . 0.0 109.324 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -52.32 134.15 34.11 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.396 -0.815 . . . . 0.0 109.225 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.47 -0.99 66.12 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.625 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 79.7 m-85 -134.17 150.25 51.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.234 -1.156 . . . . 0.0 110.55 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.04 150.82 25.38 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.804 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 2.8 m -94.0 138.27 32.28 Favored 'General case' 0 N--CA 1.403 -2.823 1 O-C-N 116.281 -4.012 . . . . 0.0 109.931 175.494 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.1 t -135.12 137.96 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.447 -0.783 . . . . 0.0 110.824 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.4 103.83 1.39 Allowed 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.696 ' O ' ' C ' ' A' ' 24' ' ' TRP . . . -93.76 -161.74 0.88 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.696 ' C ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER 14.07 94.93 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.95 0.881 . . . . 0.0 109.47 -178.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -49.26 3.42 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.68 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.905 ' H ' HD22 ' A' ' 26' ' ' ASN . 0.1 OUTLIER -81.34 -56.03 4.32 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.277 -0.889 . . . . 0.0 108.824 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.746 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 172.72 37.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.224 1.011 . . . . 0.0 108.652 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.514 ' HB3' ' HB2' ' A' ' 24' ' ' TRP . 56.4 tp60 -121.57 157.38 30.86 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.586 -1.321 . . . . 0.0 110.547 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.75 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 2.6 m -133.32 150.57 51.86 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 t -143.5 136.44 27.65 Favored 'General case' 0 C--N 1.309 -1.185 0 O-C-N 121.078 -1.013 . . . . 0.0 110.529 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 1.5 m -67.09 144.36 56.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.448 -0.783 . . . . 0.0 109.641 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -148.17 139.07 23.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.553 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.545 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -57.94 175.41 0.2 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.121 -0.987 . . . . 0.0 109.384 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.545 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 O-C-N 120.623 -1.298 . . . . 0.0 109.925 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.564 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 22.0 p . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.645 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -76.6 122.61 6.41 Favored Glycine 0 N--CA 1.486 2.014 0 C-N-CA 118.669 -1.729 . . . . 0.0 108.929 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.697 ' O ' ' C ' ' A' ' 4' ' ' LYS . 14.9 m -98.97 175.21 6.0 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.285 . . . . 0.0 108.148 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.697 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER -25.72 128.38 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.176 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.484 ' HB3' ' O ' ' A' ' 4' ' ' LYS . 14.4 ttp180 60.33 82.19 0.16 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.224 -0.923 . . . . 0.0 109.134 -178.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 176.44 129.02 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.226 -0.921 . . . . 0.0 110.582 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.585 ' HA ' ' O ' ' A' ' 29' ' ' SER . 2.0 t90 -44.66 133.25 6.04 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.572 0.701 . . . . 0.0 110.565 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.713 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 27.6 p -114.12 135.23 54.26 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -90.03 -37.04 14.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.618 -1.301 . . . . 0.0 109.487 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.54 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 0.2 OUTLIER -146.37 177.85 8.7 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.3 -0.875 . . . . 0.0 108.846 178.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -61.4 -45.5 94.09 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.328 0.585 . . . . 0.0 110.074 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -81.06 -15.52 55.83 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 119.667 -1.895 . . . . 0.0 112.214 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.54 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -71.81 -7.79 50.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.105 -0.997 . . . . 0.0 111.243 -178.286 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.51 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 51.3 m -88.13 142.79 27.48 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.446 -1.409 . . . . 0.0 107.758 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.503 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -53.09 148.97 7.27 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.542 -178.523 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -49.17 120.19 3.82 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.134 0.968 . . . . 0.0 109.746 -178.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.94 -1.27 35.74 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 4' ' ' LYS . 82.7 m-85 -131.15 144.82 51.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.449 -1.03 . . . . 0.0 108.587 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 9.2 p-10 -118.31 169.08 10.03 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.028 -1.045 . . . . 0.0 110.333 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.1 t -89.45 128.42 35.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.667 -0.645 . . . . 0.0 109.436 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.5 t -127.71 130.74 70.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.367 -0.833 . . . . 0.0 109.459 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -72.79 118.38 15.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.181 -0.949 . . . . 0.0 109.066 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -89.94 95.16 10.1 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.412 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p-90 -52.87 -40.46 63.45 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.523 -0.736 . . . . 0.0 110.517 -178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.642 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.4 OUTLIER -73.9 136.56 43.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.854 -1.154 . . . . 0.0 108.606 179.873 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER 55.95 13.22 1.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.28 -0.888 . . . . 0.0 109.07 -178.389 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 2.0 mp0 50.51 -155.53 0.12 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.408 -0.808 . . . . 0.0 109.888 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.946 HE21 ' H ' ' A' ' 29' ' ' SER . 1.7 tp60 63.56 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.261 -0.899 . . . . 0.0 110.062 -179.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.946 ' H ' HE21 ' A' ' 28' ' ' GLN . 70.6 m -100.9 157.03 17.03 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.334 178.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.6 t -136.69 139.06 41.69 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.233 -0.917 . . . . 0.0 110.653 -179.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.713 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 91.3 m -66.87 148.24 52.2 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.494 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 4.6 pt-20 -144.25 139.69 28.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.972 -1.08 . . . . 0.0 108.982 178.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 33' ' ' ARG . 3.9 ttm180 -64.21 155.01 33.15 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.311 -0.868 . . . . 0.0 110.735 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.3 -1.58 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.733 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.674 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -73.57 150.17 42.9 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.464 ' O ' ' C ' ' A' ' 4' ' ' LYS . 50.2 m -105.26 -170.2 1.71 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.355 -1.085 . . . . 0.0 109.505 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.464 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.6 OUTLIER -37.52 121.84 0.89 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.219 -0.925 . . . . 0.0 109.91 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.612 ' N ' ' O ' ' A' ' 31' ' ' CYS . 42.5 ttp180 48.89 86.05 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 178.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.476 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -173.03 124.23 0.42 Allowed 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 121.975 0.893 . . . . 0.0 109.668 -178.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.714 ' HA ' ' O ' ' A' ' 29' ' ' SER . 34.7 t90 -24.54 142.67 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.21 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.678 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -130.95 157.08 43.91 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.731 0.777 . . . . 0.0 110.574 179.379 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 30.5 mttm -88.49 -40.82 13.16 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 177.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.52 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 51.1 mm-40 -159.41 -173.65 4.28 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 121.541 0.686 . . . . 0.0 109.173 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.584 ' HG3' ' OD1' ' A' ' 19' ' ' ASN . 53.5 tttm -67.94 -45.82 73.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.363 -0.836 . . . . 0.0 109.986 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -12.83 60.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.529 -0.732 . . . . 0.0 110.099 -178.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.52 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 12.4 m-20 -85.4 2.58 43.82 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.045 -1.034 . . . . 0.0 111.549 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 3.8 m -85.38 143.38 28.67 Favored 'General case' 0 C--N 1.308 -1.237 0 O-C-N 120.428 -1.42 . . . . 0.0 108.408 179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.733 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 11.0 m -54.56 138.92 39.69 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.323 -0.861 . . . . 0.0 108.708 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 44.4 t -34.12 148.49 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.404 ' O ' ' HD3' ' A' ' 33' ' ' ARG . . . 74.94 1.38 62.53 Favored Glycine 0 N--CA 1.493 2.44 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.706 ' HB3' ' HB3' ' A' ' 31' ' ' CYS . 62.8 m-85 -135.93 156.57 48.57 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.5 -1.589 . . . . 0.0 111.157 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 1.055 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 32.1 t30 -131.05 169.24 16.13 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.727 . . . . 0.0 110.391 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 6.3 t -90.35 109.08 20.2 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.915 -1.116 . . . . 0.0 109.94 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.679 HG21 ' CD ' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -103.58 134.22 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.493 -0.754 . . . . 0.0 109.797 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.536 ' CD2' ' O ' ' A' ' 23' ' ' ALA . 65.4 t80 -67.91 141.49 56.35 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.044 -1.035 . . . . 0.0 108.966 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -85.52 -148.82 0.12 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.299 -0.876 . . . . 0.0 110.01 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.416 ' CZ3' ' O ' ' A' ' 22' ' ' TYR . 0.8 OUTLIER -175.01 -49.0 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.253 -179.336 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.579 ' CE1' ' ND2' ' A' ' 26' ' ' ASN . 4.2 p90 -86.78 -34.29 19.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.61 -1.307 . . . . 0.0 108.375 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.872 ' H ' HD22 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -109.57 10.34 25.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.478 -0.764 . . . . 0.0 109.361 178.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.57 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 98.6 mm-40 54.59 -167.22 0.08 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.101 -0.999 . . . . 0.0 110.77 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 64.06 -168.36 0.21 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.537 -0.727 . . . . 0.0 109.274 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.714 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 58.9 m -131.84 147.15 52.46 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.365 -0.834 . . . . 0.0 109.441 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.8 p -128.37 143.11 50.96 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 1.055 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 77.7 m -67.63 148.08 51.85 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.006 -1.059 . . . . 0.0 109.874 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.679 ' CD ' HG21 ' A' ' 21' ' ' VAL . 0.7 OUTLIER -147.71 149.7 32.93 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.117 -0.989 . . . . 0.0 110.275 179.463 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -59.79 135.51 57.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.625 -1.297 . . . . 0.0 109.26 -179.11 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? . . . . . 0 N--CA 1.483 1.206 0 O-C-N 121.241 -0.912 . . . . 0.0 111.877 -177.938 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.649 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 121.171 0.51 . . . . 0.0 109.689 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.573 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -59.51 -89.99 0.02 OUTLIER Glycine 0 N--CA 1.494 2.513 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.287 -178.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 1.3 t 87.13 -173.78 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.683 -0.893 . . . . 0.0 110.54 -178.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.597 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 71.5 tttt -43.66 126.64 4.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.569 -0.707 . . . . 0.0 109.842 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.597 ' HG2' ' HG2' ' A' ' 4' ' ' LYS . 0.4 OUTLIER 46.92 81.26 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -177.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.81 126.78 0.1 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.242 -177.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.81 ' HA ' ' O ' ' A' ' 29' ' ' SER . 31.8 t90 -52.77 137.74 30.85 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.662 0.744 . . . . 0.0 111.692 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.707 ' SG ' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -122.03 170.98 9.3 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.478 178.405 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.707 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -121.98 -36.8 2.94 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.521 -1.362 . . . . 0.0 108.041 177.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.728 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 44.6 mt-10 -148.36 169.51 20.0 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 tptm -59.05 -23.77 62.28 Favored 'General case' 0 C--N 1.292 -1.893 0 O-C-N 121.076 -1.015 . . . . 0.0 108.72 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -93.33 -33.98 13.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.612 -0.68 . . . . 0.0 111.282 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.472 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -63.74 -6.98 6.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.006 -1.059 . . . . 0.0 110.58 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.745 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.4 t -93.96 160.77 14.58 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.497 -0.752 . . . . 0.0 108.998 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.649 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 94.1 m -56.78 140.0 49.14 Favored 'General case' 0 C--N 1.306 -1.312 0 O-C-N 120.985 -1.072 . . . . 0.0 109.108 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.43 129.31 41.24 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 104.0 -4.14 45.26 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.745 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 95.3 m-85 -117.99 141.18 48.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.942 -1.328 . . . . 0.0 109.32 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.835 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 5.3 p-10 -90.91 144.03 26.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.323 -0.86 . . . . 0.0 108.739 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.728 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 18.0 m -90.31 136.29 33.14 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.576 0.703 . . . . 0.0 111.253 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 29' ' ' SER . 41.9 t -117.25 101.48 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -73.85 114.46 12.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.338 -0.851 . . . . 0.0 109.42 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -94.93 88.81 5.4 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.279 -0.888 . . . . 0.0 110.506 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.621 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -51.86 -2.05 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.384 -0.823 . . . . 0.0 109.941 178.489 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.588 ' H ' ' C ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -60.37 -49.31 78.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.083 -1.011 . . . . 0.0 109.637 -179.047 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.555 ' ND2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -151.27 46.75 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.234 -0.916 . . . . 0.0 109.286 179.464 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 52.28 37.95 23.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.466 -0.771 . . . . 0.0 110.165 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.783 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 8.3 tt0 -120.36 114.14 21.4 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.21 -0.931 . . . . 0.0 109.513 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.81 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.7 m -95.24 172.37 8.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.948 -1.095 . . . . 0.0 109.277 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 20' ' ' CYS . 1.6 t -144.56 -157.81 0.82 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.236 -0.915 . . . . 0.0 109.849 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.835 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -165.73 138.49 4.21 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.018 -179.729 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -145.2 144.25 30.74 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.71 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 1.1 ptp85 -57.57 110.27 0.85 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.151 -0.968 . . . . 0.0 111.45 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.649 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 178.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.503 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 19.4 p . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.626 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -88.41 114.7 4.27 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.41 -1.376 . . . . 0.0 109.892 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 4' ' ' LYS . 3.6 m -94.31 -159.52 0.71 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.142 -1.211 . . . . 0.0 107.736 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 11.6 tmtt? -46.9 147.54 1.31 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.426 -1.421 . . . . 0.0 108.286 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 5' ' ' ARG . 8.1 ptm180 39.2 78.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.563 1.173 . . . . 0.0 109.286 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.71 125.96 0.08 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.442 -0.787 . . . . 0.0 109.266 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' SER . 72.5 t90 -45.06 134.1 6.19 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.578 0.704 . . . . 0.0 111.729 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -123.83 136.03 54.13 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HB3' ' CG ' ' A' ' 13' ' ' ASP . 31.0 tttm -82.73 -40.87 19.97 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.656 ' HG2' ' N ' ' A' ' 11' ' ' LYS . 62.8 tt0 -156.55 179.58 9.12 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.656 ' N ' ' HG2' ' A' ' 10' ' ' GLU . 1.6 ttpm? -58.87 -43.96 90.96 Favored 'General case' 0 C--N 1.285 -2.214 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.874 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -69.63 -37.79 76.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.358 -0.839 . . . . 0.0 110.582 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.474 ' CG ' ' HB3' ' A' ' 9' ' ' LYS . 10.3 t70 -60.34 -23.47 64.27 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.779 -1.201 . . . . 0.0 110.577 -178.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.3 t -79.56 142.96 35.24 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.024 -1.048 . . . . 0.0 108.833 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -51.47 121.95 7.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.835 0.826 . . . . 0.0 109.429 -177.759 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' CYS . 1.3 t -38.1 137.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.274 0.559 . . . . 0.0 109.523 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.79 -14.24 58.96 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 67.7 m-85 -111.23 150.47 29.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.994 -1.298 . . . . 0.0 110.312 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.628 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.9 t30 -97.46 132.24 43.35 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.442 -0.787 . . . . 0.0 109.93 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.724 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 5.3 m -85.94 143.01 28.41 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.276 -0.89 . . . . 0.0 109.863 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 30' ' ' SER . 0.3 OUTLIER -134.61 143.57 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.625 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -109.94 111.78 23.38 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 108.717 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.636 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -89.64 93.36 9.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.914 -1.116 . . . . 0.0 109.264 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -54.23 -38.14 65.4 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.403 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.611 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -60.37 -46.65 89.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.947 -1.096 . . . . 0.0 108.931 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.401 ' C ' ' H ' ' A' ' 28' ' ' GLN . 81.1 m-20 -92.45 -6.75 49.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.191 -0.943 . . . . 0.0 108.8 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.636 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER 58.72 6.48 0.62 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.432 -0.793 . . . . 0.0 109.474 -179.831 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.401 ' H ' ' C ' ' A' ' 26' ' ' ASN . 29.1 mm100 -109.99 137.19 48.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.346 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.694 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.4 m -93.82 144.5 25.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.083 -1.011 . . . . 0.0 108.427 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.477 ' O ' HG12 ' A' ' 21' ' ' VAL . 13.6 p -142.93 127.98 18.51 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.372 -0.83 . . . . 0.0 109.776 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -69.85 160.45 31.77 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.342 -0.849 . . . . 0.0 110.545 -179.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -145.18 141.28 28.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.541 -0.724 . . . . 0.0 109.057 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.455 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -70.19 128.94 37.99 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.594 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 94.5 mttt . . . . . 0 C--N 1.303 -1.431 0 O-C-N 120.856 -1.152 . . . . 0.0 109.855 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.543 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 25.5 p . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.99 129.94 9.82 Favored Glycine 0 N--CA 1.488 2.128 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 4' ' ' LYS . 29.6 m -99.28 -170.48 1.92 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -1.114 . . . . 0.0 108.541 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' A' ' 3' ' ' SER . 48.4 tttm -46.87 128.73 11.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.555 -1.341 . . . . 0.0 107.565 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.3 ttm180 62.09 79.36 0.26 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.361 -0.935 . . . . 0.0 108.635 -178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.55 129.97 0.1 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.246 -0.908 . . . . 0.0 109.927 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.795 ' HA ' ' O ' ' A' ' 29' ' ' SER . 45.4 t90 -53.27 138.47 32.16 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.424 0.63 . . . . 0.0 111.961 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.557 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -122.2 160.68 24.68 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.505 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.497 ' N ' ' OD2' ' A' ' 13' ' ' ASP . 18.3 tttt -85.78 -45.83 11.24 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.285 -0.884 . . . . 0.0 109.202 179.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.597 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 93.1 mt-10 -145.19 -167.34 2.65 Favored 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 121.661 0.744 . . . . 0.0 109.263 -179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.694 ' HZ1' HD21 ' A' ' 38' ' ' LEU . 16.9 tptt -62.67 -40.92 98.61 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.829 -0.545 . . . . 0.0 110.253 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.9 mttp -87.52 -3.07 59.0 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.112 -0.993 . . . . 0.0 110.761 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.597 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 24.8 t70 -80.93 -3.6 52.04 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.874 -1.141 . . . . 0.0 111.951 -177.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.489 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 34.2 m -86.09 145.08 27.2 Favored 'General case' 0 C--N 1.308 -1.233 0 O-C-N 120.298 -1.501 . . . . 0.0 108.862 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.543 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 72.5 m -51.39 161.67 0.43 Allowed 'General case' 0 C--N 1.306 -1.296 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 -179.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.532 ' HA ' ' CB ' ' A' ' 43' ' ' CYS . 1.0 OUTLIER -58.33 137.55 57.11 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.45 -0.781 . . . . 0.0 110.234 -178.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.41 4.3 87.98 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -130.95 141.53 50.28 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.152 -1.205 . . . . 0.0 110.414 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 31.3 p-10 -104.36 166.91 10.09 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.936 -1.102 . . . . 0.0 109.181 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 18.8 t -102.81 130.69 49.88 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.239 -0.913 . . . . 0.0 109.569 178.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.05 128.55 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -79.3 123.75 27.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.082 -1.012 . . . . 0.0 109.121 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.578 ' HB1' ' CE2' ' A' ' 25' ' ' TYR . . . -101.57 74.2 1.5 Allowed 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.285 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.1 p-90 -54.55 -36.06 63.91 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.094 -1.004 . . . . 0.0 109.786 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.578 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -56.64 -26.07 55.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.09 -1.006 . . . . 0.0 109.361 -179.723 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.557 ' ND2' ' O ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -141.73 28.85 1.75 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -0.947 . . . . 0.0 108.897 179.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' A' ' 23' ' ' ALA . 5.9 mp0 48.89 -171.0 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.523 -0.736 . . . . 0.0 109.23 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.46 ' O ' ' O ' ' A' ' 27' ' ' GLN . 4.0 mm-40 57.87 153.93 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.36 -0.838 . . . . 0.0 110.196 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.795 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 40.4 m -114.69 132.76 56.3 Favored 'General case' 1 C--O 1.148 -4.243 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.328 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.7 p -107.91 127.09 53.44 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.591 0.71 . . . . 0.0 110.75 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.58 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 79.9 m -71.66 148.92 46.03 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.443 -0.786 . . . . 0.0 110.263 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.501 ' O ' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -147.02 149.56 33.37 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.73 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.616 ' O ' ' CB ' ' A' ' 34' ' ' LYS . 10.4 ptt180 -51.93 -165.24 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.055 -1.028 . . . . 0.0 111.66 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.616 ' CB ' ' O ' ' A' ' 33' ' ' ARG . 91.7 mttt 121.4 106.6 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 123.592 0.757 . . . . 0.0 109.807 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 39.7 m0 -114.02 -74.04 0.64 Allowed 'General case' 0 N--CA 1.492 1.675 0 CA-C-O 123.224 1.488 . . . . 0.0 108.593 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -63.03 -31.2 72.29 Favored 'General case' 0 C--N 1.29 -2.014 0 O-C-N 120.806 -1.184 . . . . 0.0 109.722 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -77.44 12.74 1.44 Allowed 'General case' 0 C--N 1.292 -1.928 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.399 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.694 HD21 ' HZ1' ' A' ' 11' ' ' LYS . 4.1 tp -131.04 145.94 52.2 Favored 'General case' 0 C--N 1.308 -1.202 0 O-C-N 120.994 -1.066 . . . . 0.0 109.884 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.503 ' O ' ' N ' ' A' ' 41' ' ' GLY . 3.2 m-85 -57.33 142.85 42.01 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.467 -0.77 . . . . 0.0 109.748 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.428 ' C ' ' O ' ' A' ' 39' ' ' PHE . 75.9 p 42.62 -95.47 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.459 -0.776 . . . . 0.0 109.909 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 42' ' ' GLU . . . 123.32 -133.68 9.09 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 108.908 -1.677 . . . . 0.0 108.908 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.556 ' O ' ' O ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER 54.42 112.11 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.357 -1.084 . . . . 0.0 108.584 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.532 ' CB ' ' HA ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.105 -0.997 . . . . 0.0 110.252 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.513 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 28.8 p . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.637 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -73.29 118.45 6.27 Favored Glycine 0 N--CA 1.487 2.054 0 N-CA-C 108.19 -1.964 . . . . 0.0 108.19 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.7 m -99.02 -161.21 0.86 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.306 . . . . 0.0 109.056 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.3 tttm -53.14 125.06 16.18 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 6' ' ' ALA . 96.2 mtt-85 56.46 86.82 0.06 Allowed 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 178.52 135.25 0.08 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.771 0.796 . . . . 0.0 109.955 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.705 ' HA ' ' O ' ' A' ' 29' ' ' SER . 40.7 t90 -50.54 143.57 9.06 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.603 0.716 . . . . 0.0 111.061 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.63 148.37 46.51 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -95.24 -32.04 13.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.918 -1.114 . . . . 0.0 109.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 78.4 mm-40 -154.65 177.92 10.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.354 -0.841 . . . . 0.0 108.885 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -60.35 -48.86 79.94 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.42 ' C ' ' H ' ' A' ' 14' ' ' CYS . 16.4 ttmm -76.47 -35.03 58.66 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.741 -0.6 . . . . 0.0 111.128 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.49 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 7.8 m-20 -59.87 -1.3 0.27 Allowed 'General case' 0 N--CA 1.482 1.14 0 O-C-N 121.004 -1.06 . . . . 0.0 110.618 -178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.692 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 47.9 t -90.58 147.68 23.18 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.021 -1.049 . . . . 0.0 108.753 179.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.513 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -58.1 139.83 53.94 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.217 -0.927 . . . . 0.0 109.677 -179.328 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 126.22 21.41 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 119.831 -0.747 . . . . 0.0 109.024 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.62 -6.78 24.33 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.692 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 86.0 m-85 -128.69 143.75 51.01 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.307 -1.114 . . . . 0.0 110.792 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.542 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 65.5 t30 -102.9 145.84 29.2 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.494 -0.754 . . . . 0.0 109.123 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.4 t -86.95 128.92 35.06 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.031 -1.043 . . . . 0.0 109.143 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 88.3 t -128.6 136.38 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.568 -0.707 . . . . 0.0 110.061 -178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -66.63 140.41 57.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.409 -0.807 . . . . 0.0 109.305 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.045 ' HB1' HD21 ' A' ' 26' ' ' ASN . . . -87.2 -142.58 0.11 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.519 -0.738 . . . . 0.0 110.27 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.518 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 8.9 p90 -172.22 -42.15 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.991 -0.683 . . . . 0.0 111.188 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.518 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -100.01 11.03 40.3 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.41 -1.432 . . . . 0.0 110.078 179.334 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 1.068 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -140.42 2.41 1.85 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.448 -0.783 . . . . 0.0 109.127 178.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 97.3 mm-40 46.79 34.21 2.49 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.089 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -122.57 -167.79 1.63 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.51 -0.744 . . . . 0.0 109.276 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.705 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.2 m -127.86 123.41 35.02 Favored 'General case' 0 C--O 1.181 -2.54 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.4 p -112.8 120.01 39.99 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.194 -0.941 . . . . 0.0 110.143 -178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -67.39 143.61 56.22 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.716 179.607 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -148.02 134.56 19.77 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.62 ' O ' ' CD1' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -62.6 110.8 1.82 Allowed 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.15 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.401 ' HG2' ' H ' ' A' ' 34' ' ' LYS . 46.5 pttt -68.94 -13.31 62.37 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 120.973 -1.08 . . . . 0.0 111.286 -178.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.744 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 36.4 m95 57.43 -162.05 0.21 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 120.996 -1.065 . . . . 0.0 109.441 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.744 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 98.7 mttt 90.73 -1.98 0.23 Allowed 'General case' 0 N--CA 1.495 1.822 0 CA-C-O 120.982 0.42 . . . . 0.0 109.954 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.609 ' OH ' ' HD3' ' A' ' 33' ' ' ARG . 30.8 p90 -131.88 79.47 1.87 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.29 -0.881 . . . . 0.0 109.774 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.694 ' O ' ' C ' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -64.94 157.18 28.79 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.378 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.694 ' C ' ' O ' ' A' ' 38' ' ' LEU . 0.4 OUTLIER 13.77 78.57 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 121.852 0.834 . . . . 0.0 109.87 -178.477 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.5 m -163.36 145.15 9.69 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.22 146.22 43.46 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.492 ' CD ' ' CZ ' ' A' ' 37' ' ' TYR . 1.9 tt0 -142.59 156.94 45.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.405 -1.056 . . . . 0.0 109.513 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.402 ' OXT' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 117.944 -1.027 . . . . 0.0 109.276 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.488 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 26.2 p . . . . . 0 N--CA 1.489 1.485 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.51 138.39 28.83 Favored Glycine 0 N--CA 1.49 2.241 0 N-CA-C 108.694 -1.762 . . . . 0.0 108.694 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.541 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 26.1 t -100.7 -138.63 0.33 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.281 -1.129 . . . . 0.0 108.701 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.541 ' N ' ' OG ' ' A' ' 3' ' ' SER . 12.7 tmtt? -61.39 128.43 36.28 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.675 -1.265 . . . . 0.0 107.745 179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.682 ' N ' ' O ' ' A' ' 31' ' ' CYS . 45.0 ptt85 41.76 90.81 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 122.578 1.18 . . . . 0.0 108.92 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -169.59 139.15 2.0 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-O 122.039 0.923 . . . . 0.0 109.377 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.729 ' HE1' ' HZ2' ' A' ' 9' ' ' LYS . 0.6 OUTLIER -47.07 131.63 12.42 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.713 0.768 . . . . 0.0 112.217 -177.603 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.587 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -121.09 152.32 38.82 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 177.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.729 ' HZ2' ' HE1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -98.6 -28.37 13.59 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 120.897 -1.127 . . . . 0.0 109.058 178.618 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.648 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 24.5 mt-10 -145.33 179.2 7.55 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-O 121.761 0.791 . . . . 0.0 109.825 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tttt -61.26 -47.61 85.23 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.443 -0.786 . . . . 0.0 109.003 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 14' ' ' CYS . 85.1 tttt -83.56 -22.35 32.38 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.397 -0.815 . . . . 0.0 109.898 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.648 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 14.7 t70 -47.33 -11.88 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.019 -1.05 . . . . 0.0 109.882 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.547 ' N ' ' O ' ' A' ' 12' ' ' LYS . 59.9 m -83.25 133.57 34.99 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.417 -1.327 . . . . 0.0 107.417 179.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.475 ' C ' ' O ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -42.07 145.99 0.32 Allowed 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.358 -0.839 . . . . 0.0 109.378 -178.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -49.67 125.42 11.51 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.557 -0.714 . . . . 0.0 109.209 -179.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.01 0.25 41.6 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.302 -1.519 . . . . 0.0 109.302 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -129.84 141.95 50.75 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.609 -0.936 . . . . 0.0 109.501 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.699 ' ND2' ' O ' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -103.56 158.89 16.05 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.212 -0.93 . . . . 0.0 109.24 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 39.1 t -92.37 112.67 24.7 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.763 -1.211 . . . . 0.0 110.031 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.49 ' O ' ' CB ' ' A' ' 29' ' ' SER . 75.5 t -89.28 132.07 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -81.02 124.53 29.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.245 -0.91 . . . . 0.0 109.292 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.781 ' HB1' ' CE2' ' A' ' 25' ' ' TYR . . . -114.03 118.63 34.64 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.949 0.88 . . . . 0.0 110.55 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.584 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -54.29 -11.95 0.58 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.781 ' CE2' ' HB1' ' A' ' 23' ' ' ALA . 34.7 p90 -94.75 129.92 41.49 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.371 -1.456 . . . . 0.0 110.102 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.604 ' O ' ' C ' ' A' ' 27' ' ' GLN . 68.1 m-20 55.14 34.16 22.02 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.478 -0.764 . . . . 0.0 109.446 -179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.604 ' C ' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 29.44 43.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 CA-C-O 122.261 1.029 . . . . 0.0 108.592 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.59 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 1.2 tm0? -111.36 163.62 13.79 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.667 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 14.6 m -125.8 148.33 49.15 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.185 -0.947 . . . . 0.0 110.473 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.4 p -108.44 117.21 33.57 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.63 -0.669 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.682 ' O ' ' N ' ' A' ' 5' ' ' ARG . 96.6 m -65.74 130.55 43.66 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.955 -1.091 . . . . 0.0 109.131 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.699 ' O ' ' ND2' ' A' ' 19' ' ' ASN . 95.5 mt-10 -146.98 135.09 21.54 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 120.966 -1.084 . . . . 0.0 110.639 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -74.92 107.45 7.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.402 -0.811 . . . . 0.0 110.183 178.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HG3' HD21 ' A' ' 19' ' ' ASN . 0.1 OUTLIER 178.03 41.92 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.563 -1.336 . . . . 0.0 111.461 178.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.573 ' O ' ' N ' ' A' ' 37' ' ' TYR . 5.1 m95 -120.54 -165.28 1.18 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.024 -1.047 . . . . 0.0 108.844 178.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.6 tttp -62.67 67.73 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.319 -0.863 . . . . 0.0 109.535 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.573 ' N ' ' O ' ' A' ' 35' ' ' TRP . 3.8 m-85 -115.77 44.51 1.89 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.274 -0.891 . . . . 0.0 109.254 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 48.4 tp -62.74 -42.28 99.59 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.083 -1.011 . . . . 0.0 108.4 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.2 t80 178.08 62.4 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -80.7 -4.87 55.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.265 -0.897 . . . . 0.0 110.253 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.6 ' O ' ' HG2' ' A' ' 42' ' ' GLU . . . 65.2 95.56 0.02 OUTLIER Glycine 0 N--CA 1.49 2.249 0 N-CA-C 108.616 -1.794 . . . . 0.0 108.616 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.683 ' O ' ' C ' ' A' ' 43' ' ' CYS . 3.5 pt-20 54.49 116.56 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.677 -0.896 . . . . 0.0 109.356 -179.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.683 ' C ' ' O ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.702 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.547 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.4 p . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.01 141.15 35.53 Favored Glycine 0 N--CA 1.487 2.098 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.6 m -108.09 -152.96 0.49 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.378 -1.072 . . . . 0.0 109.207 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.07 118.83 4.35 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.098 -1.001 . . . . 0.0 108.588 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.543 ' HE ' ' CA ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 53.96 91.55 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 122.087 0.946 . . . . 0.0 108.555 -178.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -175.77 125.7 0.22 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.844 0.83 . . . . 0.0 109.092 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.648 ' HA ' ' O ' ' A' ' 29' ' ' SER . 1.9 t90 -40.15 138.31 0.87 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 121.611 0.719 . . . . 0.0 110.856 -179.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -111.57 140.28 46.31 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.6 tttm -86.71 -37.68 17.7 Favored 'General case' 0 C--N 1.294 -1.814 0 O-C-N 121.415 -0.803 . . . . 0.0 109.09 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.64 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 28.2 mt-10 -151.26 162.77 40.3 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.519 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -57.55 -32.64 67.31 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.104 -0.997 . . . . 0.0 108.611 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.421 ' HD2' ' HZ2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -87.5 -4.63 58.99 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.065 -1.022 . . . . 0.0 109.57 178.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.544 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -92.64 5.15 52.03 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.811 -1.181 . . . . 0.0 111.651 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.776 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 16.5 m -88.39 140.2 29.71 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.268 -1.52 . . . . 0.0 107.665 178.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.547 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 73.6 m -51.11 146.81 5.96 Favored 'General case' 0 N--CA 1.502 2.132 0 C-N-CA 117.078 -1.849 . . . . 0.0 110.407 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -52.01 118.63 3.59 Favored 'General case' 0 C--N 1.294 -1.831 0 O-C-N 121.195 -0.94 . . . . 0.0 110.259 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.05 -14.45 11.16 Favored Glycine 1 N--CA 1.534 5.167 0 C-N-CA 119.214 -1.47 . . . . 0.0 109.748 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -125.86 144.69 50.56 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.33 -1.1 . . . . 0.0 109.156 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.605 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 p-10 -108.64 175.73 5.36 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.039 -1.038 . . . . 0.0 109.404 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.64 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 1.6 m -90.5 135.84 33.44 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.851 -1.156 . . . . 0.0 110.472 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.63 100.56 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -67.32 126.14 28.32 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.12 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -89.15 100.83 13.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.275 -0.89 . . . . 0.0 108.931 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.486 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -50.17 -27.65 6.19 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 108.869 -179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.456 ' O ' ' N ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -99.41 149.5 23.12 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.496 ' OD1' ' O ' ' A' ' 26' ' ' ASN . 1.1 p30 51.29 12.47 0.14 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.968 -1.082 . . . . 0.0 108.852 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.503 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 97.1 mm-40 43.94 -148.81 0.06 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.512 -0.742 . . . . 0.0 109.119 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.454 ' O ' ' O ' ' A' ' 27' ' ' GLN . 98.6 mt-30 60.39 134.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.264 -0.897 . . . . 0.0 110.214 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.648 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 34.2 m -96.89 170.47 9.14 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.456 -0.778 . . . . 0.0 109.537 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.9 t -141.21 129.69 22.56 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.321 -0.862 . . . . 0.0 109.431 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.605 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 96.5 m -72.27 131.27 42.47 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.615 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.409 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 1.0 OUTLIER -150.05 128.41 12.14 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.152 -0.968 . . . . 0.0 109.979 179.471 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.499 ' C ' ' CD ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.69 146.57 54.55 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.445 -0.784 . . . . 0.0 109.647 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HE3' HD21 ' A' ' 19' ' ' ASN . 42.1 mttt -126.14 -99.32 0.39 Allowed 'General case' 0 N--CA 1.485 1.278 0 O-C-N 121.248 -0.908 . . . . 0.0 110.48 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -118.5 158.73 24.81 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.825 0.821 . . . . 0.0 109.884 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.1 tttp -66.53 -10.04 40.98 Favored 'General case' 0 C--N 1.299 -1.628 0 O-C-N 121.713 -0.617 . . . . 0.0 110.635 -179.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.566 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -67.45 -8.56 34.28 Favored 'General case' 0 C--N 1.297 -1.683 0 O-C-N 120.912 -1.117 . . . . 0.0 108.698 -179.02 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.602 ' O ' ' O ' ' A' ' 39' ' ' PHE . 23.4 tp -62.41 -35.26 78.67 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.61 ' O ' ' CB ' ' A' ' 40' ' ' THR . 0.1 OUTLIER -50.93 -164.04 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 178.617 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.61 ' CB ' ' O ' ' A' ' 39' ' ' PHE . 2.5 m 87.14 25.99 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.102 -0.999 . . . . 0.0 109.676 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.68 -0.89 42.27 Favored Glycine 0 N--CA 1.496 2.652 0 N-CA-C 110.299 -1.12 . . . . 0.0 110.299 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.498 ' OE1' ' N ' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -127.05 120.15 28.3 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.154 -1.204 . . . . 0.0 109.667 179.734 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.498 ' N ' ' OE1' ' A' ' 42' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.303 -1.434 0 CA-C-O 117.974 -1.012 . . . . 0.0 108.711 179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.582 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 26.6 p . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 7' ' ' TRP . . . -63.02 120.12 20.01 Favored Glycine 0 N--CA 1.483 1.824 0 N-CA-C 108.247 -1.941 . . . . 0.0 108.247 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.562 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 10.9 t -96.69 -163.49 1.05 Allowed 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.181 -1.188 . . . . 0.0 108.744 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.562 ' N ' ' OG ' ' A' ' 3' ' ' SER . 15.7 tttp -45.47 121.59 3.09 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.187 -0.946 . . . . 0.0 108.604 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 56.66 86.89 0.06 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.15 152.43 1.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.337 -0.852 . . . . 0.0 110.865 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.64 ' HA ' ' O ' ' A' ' 29' ' ' SER . 20.2 t90 -53.7 154.19 3.95 Favored 'General case' 0 N--CA 1.499 2.013 0 CA-C-O 121.905 0.859 . . . . 0.0 112.213 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.645 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -132.11 136.01 46.83 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -87.95 -46.94 8.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.589 -1.319 . . . . 0.0 107.547 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.783 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 95.7 mt-10 -141.38 178.41 7.45 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.466 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 18.1 tttt -58.38 -45.98 87.25 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.516 -0.874 . . . . 0.0 109.432 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' NZ ' ' CB ' ' A' ' 12' ' ' LYS . 0.2 OUTLIER -71.04 -34.33 71.17 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.198 -0.939 . . . . 0.0 110.44 179.351 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.602 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 3.4 t70 -52.91 -6.76 0.06 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.292 -0.88 . . . . 0.0 112.045 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.711 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 12.7 m -86.47 146.46 26.4 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 120.404 -1.435 . . . . 0.0 108.904 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.582 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 71.0 m -52.87 137.05 33.07 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -46.03 122.97 4.19 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.396 -0.815 . . . . 0.0 109.753 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.61 -8.07 24.15 Favored Glycine 0 N--CA 1.493 2.48 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -125.52 142.52 51.46 Favored 'General case' 0 C--O 1.286 2.989 0 O-C-N 121.092 -1.24 . . . . 0.0 111.829 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.495 ' ND2' ' N ' ' A' ' 20' ' ' CYS . 2.8 t30 -100.12 163.2 12.52 Favored 'General case' 0 N--CA 1.499 2.007 1 O-C-N 116.067 -4.145 . . . . 0.0 108.952 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.783 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 24.8 m -90.19 130.71 36.3 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 120.488 -1.382 . . . . 0.0 109.849 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 30' ' ' SER . 0.3 OUTLIER -133.84 159.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.589 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.438 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 57.2 t80 -102.99 127.47 50.21 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.187 -0.946 . . . . 0.0 110.137 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' C ' ' H ' ' A' ' 25' ' ' TYR . . . -93.49 113.0 25.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.161 -0.962 . . . . 0.0 109.257 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.1 p-90 -53.89 1.73 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.323 -0.861 . . . . 0.0 110.74 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.585 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 36.2 p90 -123.91 148.24 47.02 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.991 -1.068 . . . . 0.0 109.224 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.585 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 54.51 17.22 1.55 Allowed 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -178.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.516 ' C ' ' O ' ' A' ' 26' ' ' ASN . 53.7 mm-40 24.94 65.08 0.05 Allowed 'General case' 0 N--CA 1.5 2.048 0 CA-C-O 121.12 0.486 . . . . 0.0 111.459 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.568 ' HB3' HD21 ' A' ' 26' ' ' ASN . 41.8 tt0 -132.42 155.68 48.06 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.232 -0.917 . . . . 0.0 109.742 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.64 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.4 m -90.17 118.64 29.85 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.411 ' O ' HG12 ' A' ' 21' ' ' VAL . 27.3 t -103.98 124.24 48.65 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 120.963 -1.086 . . . . 0.0 111.184 -178.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 88.4 m -67.48 119.24 11.97 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.134 -0.978 . . . . 0.0 109.316 179.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.474 ' O ' ' CG ' ' A' ' 32' ' ' GLU . 1.9 pt-20 -144.5 121.31 11.25 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.578 ' NH2' HD23 ' A' ' 38' ' ' LEU . 4.3 tpt180 -70.93 167.05 19.91 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.683 -1.261 . . . . 0.0 110.194 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.662 ' C ' ' CG ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -127.33 40.67 3.66 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.325 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.682 ' O ' ' C ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER 59.13 -87.15 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.071 -1.018 . . . . 0.0 108.942 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.682 ' C ' ' O ' ' A' ' 35' ' ' TRP . 37.6 mttt 7.91 78.38 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 CA-C-O 121.211 0.529 . . . . 0.0 110.43 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -55.01 79.22 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 CA-C-O 121.878 0.847 . . . . 0.0 109.843 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.858 HD12 ' H ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -57.1 -174.4 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 179.562 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.858 ' H ' HD12 ' A' ' 38' ' ' LEU . 50.5 t80 -166.68 97.42 0.56 Allowed 'General case' 0 C--N 1.306 -1.325 0 O-C-N 120.96 -1.087 . . . . 0.0 109.698 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.751 ' OG1' HD11 ' A' ' 38' ' ' LEU . 2.5 p -159.64 113.76 2.3 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 179.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 67.74 -135.87 30.98 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 107.819 -2.112 . . . . 0.0 107.819 -178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -144.8 97.01 2.96 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.904 -1.35 . . . . 0.0 109.826 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.307 -1.254 0 O-C-N 121.043 -1.036 . . . . 0.0 108.991 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.528 ' HB2' ' CA ' ' A' ' 15' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -81.03 132.69 11.4 Favored Glycine 0 N--CA 1.494 2.505 0 N-CA-C 109.806 -1.318 . . . . 0.0 109.806 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.475 ' O ' ' C ' ' A' ' 4' ' ' LYS . 21.7 m -104.45 -162.45 0.89 Allowed 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.357 -1.084 . . . . 0.0 108.675 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.475 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.9 OUTLIER -44.25 130.93 6.3 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.649 -1.282 . . . . 0.0 108.096 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.9 mtp85 54.37 82.51 0.09 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 120.989 -1.069 . . . . 0.0 108.713 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 125.62 0.24 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.996 -1.065 . . . . 0.0 110.514 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.542 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.1 t90 -49.07 131.32 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.419 0.628 . . . . 0.0 111.078 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.525 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -117.87 153.17 33.99 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 178.26 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.72 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 6.8 tmtt? -94.77 -25.19 16.76 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.03 . . . . 0.0 108.718 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.539 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 5.9 pt-20 -165.65 -171.82 2.21 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.408 -0.807 . . . . 0.0 109.277 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.42 -45.25 94.29 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.301 -0.874 . . . . 0.0 109.229 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 21.9 tptp -70.39 -25.26 63.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.593 -0.692 . . . . 0.0 110.327 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.72 ' CG ' ' H ' ' A' ' 9' ' ' LYS . 11.5 t70 -63.75 -17.62 63.22 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.274 -0.891 . . . . 0.0 111.956 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.1 m -83.57 122.17 28.2 Favored 'General case' 0 C--N 1.307 -1.275 0 O-C-N 119.943 -1.723 . . . . 0.0 107.961 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.537 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.99 -173.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 122.132 0.967 . . . . 0.0 111.418 -177.81 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.537 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.5 OUTLIER 22.08 -143.23 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.722 177.281 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.692 ' H ' ' CB ' ' A' ' 43' ' ' CYS . . . -89.45 29.94 5.92 Favored Glycine 0 C--N 1.284 -2.348 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 -179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.602 ' CD1' ' HB2' ' A' ' 33' ' ' ARG . 91.4 m-85 -82.83 135.41 34.96 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.534 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 17.3 p-10 -99.07 149.0 23.46 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.951 -1.093 . . . . 0.0 109.391 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.469 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 15.2 t -90.89 126.27 36.0 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.148 -0.97 . . . . 0.0 110.152 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 66.7 t -120.25 130.95 73.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.486 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 14.5 t80 -78.12 122.41 25.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.906 -1.121 . . . . 0.0 109.025 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' TYR . . . -98.38 88.66 4.2 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -7.67 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.099 -1.001 . . . . 0.0 109.469 179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ALA . 3.4 m-85 -58.47 -46.69 86.1 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.082 -1.011 . . . . 0.0 109.864 -179.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.632 HD22 ' N ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -147.98 45.63 1.08 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.05 -1.031 . . . . 0.0 109.797 -179.597 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.486 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 96.6 mm-40 44.12 42.84 5.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.225 -0.922 . . . . 0.0 109.025 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -120.93 138.42 54.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.737 -0.602 . . . . 0.0 109.691 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.542 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 0.7 OUTLIER -95.62 112.95 24.56 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.293 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.0 t -98.52 114.98 27.59 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 121.042 -1.036 . . . . 0.0 110.831 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 18' ' ' TYR . 89.0 m -67.89 145.22 54.8 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.262 -0.898 . . . . 0.0 109.183 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.534 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 97.8 mt-10 -146.46 107.45 4.16 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.987 -1.071 . . . . 0.0 112.077 -178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.733 ' HD2' ' H ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -79.14 131.84 36.35 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.613 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 38.2 mtmt -111.65 19.47 18.05 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 120.699 -1.25 . . . . 0.0 108.44 178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.733 ' H ' ' HD2' ' A' ' 33' ' ' ARG . 32.0 m95 -117.65 -3.3 11.31 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -56.47 27.16 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.655 -0.653 . . . . 0.0 110.686 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.706 ' N ' ' O ' ' A' ' 35' ' ' TRP . 85.6 m-85 -101.58 104.38 15.25 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.919 ' O ' ' HB2' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 70.08 163.6 0.25 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.204 -0.935 . . . . 0.0 108.631 -178.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.919 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 0.2 OUTLIER 102.26 176.22 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.689 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -74.75 175.87 7.54 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.224 -0.922 . . . . 0.0 109.725 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.471 ' N ' ' OG1' ' A' ' 40' ' ' THR . . . -58.43 2.11 0.22 Allowed Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.581 ' H ' ' C ' ' A' ' 40' ' ' THR . 80.5 tt0 -94.86 133.89 38.09 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.262 -1.14 . . . . 0.0 108.79 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.692 ' CB ' ' H ' ' A' ' 17' ' ' GLY . 1.2 p . . . . . 0 N--CA 1.496 1.857 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.594 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.786 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 11.0 p . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.068 0.461 . . . . 0.0 110.173 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.56 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -66.14 -51.07 47.36 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.542 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 2.6 t 86.33 -169.2 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 121.471 0.653 . . . . 0.0 110.298 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 24.4 tttm -52.36 128.63 26.05 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.345 -0.847 . . . . 0.0 109.366 -178.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.6 ttm-85 49.18 84.2 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.56 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.12 139.53 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.809 -0.757 . . . . 0.0 110.46 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.877 ' HA ' ' O ' ' A' ' 29' ' ' SER . 41.3 t90 -43.69 127.02 4.84 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.511 0.672 . . . . 0.0 110.878 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.54 ' O ' ' HB2' ' A' ' 29' ' ' SER . 22.0 p -123.98 133.61 53.65 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -91.82 -44.73 8.79 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.405 -1.434 . . . . 0.0 109.139 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.441 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 18.6 mt-10 -149.72 178.45 8.86 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -61.03 -47.61 85.64 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.59 -0.694 . . . . 0.0 109.989 178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -69.26 -38.16 78.27 Favored 'General case' 0 C--N 1.292 -1.926 0 O-C-N 120.307 -1.495 . . . . 0.0 112.564 178.764 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.441 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 97.2 m-20 -66.98 -10.83 53.78 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.144 -0.972 . . . . 0.0 109.888 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.522 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 22.9 t -91.97 150.95 20.73 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.209 -0.932 . . . . 0.0 109.825 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.786 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.7 OUTLIER -61.89 135.88 57.75 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.38 143.25 6.68 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 120.761 -1.212 . . . . 0.0 109.039 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.19 -3.64 69.85 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.522 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 48.2 m-85 -125.92 141.28 52.04 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.297 -1.12 . . . . 0.0 111.284 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.53 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 12.5 p-10 -98.42 144.12 28.13 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 t -88.43 136.31 33.05 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.555 -0.716 . . . . 0.0 109.691 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.426 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 72.4 t -123.13 131.27 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -102.8 122.64 44.91 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.114 -0.991 . . . . 0.0 108.351 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB1' ' CE1' ' A' ' 25' ' ' TYR . . . -89.34 115.3 26.7 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.752 -1.218 . . . . 0.0 109.498 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.406 ' CD1' ' CD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -50.49 -27.19 6.12 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.623 -0.673 . . . . 0.0 110.06 -179.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.956 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 2.1 p90 -99.23 164.5 12.11 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.003 -1.061 . . . . 0.0 110.175 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.956 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER 45.78 13.6 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 CA-C-O 121.143 0.497 . . . . 0.0 110.339 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 25' ' ' TYR . 95.3 mm-40 34.0 46.3 0.14 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.616 -0.677 . . . . 0.0 111.04 179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.701 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 1.9 tp60 -120.23 127.07 52.08 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.256 -0.903 . . . . 0.0 109.29 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.877 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.5 m -101.42 150.86 22.6 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.588 -0.894 . . . . 0.0 108.588 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.552 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 27.7 t -149.32 129.43 13.58 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 120.626 -1.296 . . . . 0.0 111.091 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.5 OUTLIER -73.22 159.95 32.67 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.289 -0.882 . . . . 0.0 111.453 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -146.09 159.03 43.85 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.323 -0.86 . . . . 0.0 110.142 178.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.583 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -60.76 132.48 54.02 Favored 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.699 0.761 . . . . 0.0 111.878 -178.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 5.8 mmmt -150.69 39.68 0.72 Allowed 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.548 ' CD1' ' N ' ' A' ' 35' ' ' TRP . 18.9 m0 64.14 -162.58 0.27 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.7 -0.625 . . . . 0.0 110.122 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.18 23.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.71 -1.244 . . . . 0.0 111.182 -178.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.52 -7.43 4.15 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.894 -1.129 . . . . 0.0 109.979 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' A' ' 39' ' ' PHE . 1.4 mm? -63.25 -44.83 94.05 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.259 -0.901 . . . . 0.0 111.357 -178.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.501 ' O ' ' O ' ' A' ' 38' ' ' LEU . 27.3 m-85 -60.55 -117.6 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.579 -1.325 . . . . 0.0 108.775 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.5 HG23 ' O ' ' A' ' 39' ' ' PHE . 33.3 p -158.58 139.67 13.08 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.182 -0.949 . . . . 0.0 108.77 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.474 ' O ' ' O ' ' A' ' 40' ' ' THR . . . 44.65 93.98 0.01 OUTLIER Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 63.07 159.73 0.08 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.029 -1.277 . . . . 0.0 108.466 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.494 ' SG ' ' OXT' ' A' ' 43' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.017 -1.052 . . . . 0.0 109.31 -179.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 120.919 0.39 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.614 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -52.98 122.6 21.23 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 108.926 -1.67 . . . . 0.0 108.926 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 4' ' ' LYS . 14.7 t -102.23 -166.36 1.28 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.297 -1.119 . . . . 0.0 109.466 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' N ' ' OG ' ' A' ' 3' ' ' SER . 0.5 OUTLIER -39.86 116.52 0.65 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.956 -1.09 . . . . 0.0 109.243 -179.406 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 5' ' ' ARG . 9.6 ttm180 59.97 86.32 0.1 Allowed 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.37 -0.932 . . . . 0.0 108.656 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.61 137.18 0.2 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.104 -0.997 . . . . 0.0 110.436 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.751 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.4 t90 -45.97 136.44 6.54 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.479 0.657 . . . . 0.0 111.94 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.993 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 2.4 p -134.11 152.29 51.77 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.655 -0.653 . . . . 0.0 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.449 ' H ' ' CG ' ' A' ' 13' ' ' ASP . 11.7 mtmt -93.03 -49.26 6.1 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 120.769 -1.207 . . . . 0.0 108.289 178.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.616 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 34.2 mp0 -138.27 178.7 6.93 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.479 ' HB2' ' HZ2' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -60.9 -43.58 98.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.793 -1.192 . . . . 0.0 108.187 179.445 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -65.89 -23.09 66.57 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.673 -0.642 . . . . 0.0 109.556 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.616 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 35.0 t70 -67.59 -16.09 63.99 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.157 -0.965 . . . . 0.0 110.701 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 83.5 m -84.81 127.33 34.08 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 120.789 -1.194 . . . . 0.0 108.128 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.568 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -57.69 -166.64 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.774 0.797 . . . . 0.0 110.906 -178.452 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 13.0 t 19.6 -139.73 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 122.411 1.1 . . . . 0.0 111.987 179.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.532 ' N ' ' SG ' ' A' ' 16' ' ' CYS . . . -97.66 33.34 5.95 Favored Glycine 0 C--N 1.287 -2.177 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.467 ' CD2' ' HB3' ' A' ' 16' ' ' CYS . 78.3 m-85 -89.61 142.77 27.37 Favored 'General case' 0 C--N 1.288 -2.077 0 O-C-N 121.792 -0.828 . . . . 0.0 109.67 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -101.49 153.64 19.53 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.394 -0.816 . . . . 0.0 110.446 -179.397 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.0 t -89.8 139.07 30.94 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.242 -0.911 . . . . 0.0 109.153 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -128.61 163.99 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.417 -0.802 . . . . 0.0 109.064 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.522 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 74.9 t80 -113.85 132.15 56.0 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.274 -0.891 . . . . 0.0 110.544 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -109.55 132.64 53.95 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.517 -0.74 . . . . 0.0 110.02 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.424 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -56.9 -46.34 82.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.6 -0.688 . . . . 0.0 111.407 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.424 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -72.92 140.58 47.56 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.726 -1.233 . . . . 0.0 110.329 -178.226 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.658 ' O ' ' C ' ' A' ' 27' ' ' GLN . 18.9 m120 56.82 25.41 10.31 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.759 -0.588 . . . . 0.0 110.235 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.658 ' C ' ' O ' ' A' ' 26' ' ' ASN . 50.6 mm-40 21.78 49.25 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.607 ' N ' ' O ' ' A' ' 26' ' ' ASN . 8.8 tt0 -115.57 141.68 47.74 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.393 -0.817 . . . . 0.0 110.248 -178.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.751 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.0 m -92.7 142.85 26.9 Favored 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -129.58 133.22 47.06 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.267 -0.896 . . . . 0.0 110.858 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.993 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 99.2 m -70.77 144.07 50.99 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.43 -0.794 . . . . 0.0 110.808 179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -151.31 135.52 16.76 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 4.2 tmm_? -58.77 143.55 46.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.22 -0.925 . . . . 0.0 110.285 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.505 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.7 OUTLIER -175.94 -83.51 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 O-C-N 121.511 -0.743 . . . . 0.0 110.025 178.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 48.4 m0 -113.64 -165.19 0.98 Allowed 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 122.167 0.984 . . . . 0.0 109.933 -179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.601 ' O ' ' CG ' ' A' ' 37' ' ' TYR . 33.3 tttt -173.33 -55.69 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.711 ' O ' ' CB ' ' A' ' 38' ' ' LEU . 4.7 m-85 176.22 -24.78 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.797 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.711 ' CB ' ' O ' ' A' ' 37' ' ' TYR . 45.3 tp 123.69 173.78 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.662 ' O ' ' O ' ' A' ' 38' ' ' LEU . 0.4 OUTLIER 30.87 107.19 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.129 -0.982 . . . . 0.0 110.669 -179.623 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.461 ' CB ' ' O ' ' A' ' 39' ' ' PHE . 4.2 m 78.37 10.44 1.92 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.633 -0.667 . . . . 0.0 109.298 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -75.64 22.06 1.85 Allowed Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.902 -1.279 . . . . 0.0 109.902 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 40' ' ' THR . 50.6 tp10 -106.74 138.6 42.6 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.286 -1.126 . . . . 0.0 109.57 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.8 t . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 117.904 -1.045 . . . . 0.0 109.343 179.509 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.734 ' HA ' ' O ' ' A' ' 13' ' ' ASP . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.394 0.616 . . . . 0.0 109.969 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.2 150.77 51.99 Favored Glycine 0 N--CA 1.485 1.931 0 N-CA-C 108.336 -1.906 . . . . 0.0 108.336 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' C ' ' A' ' 4' ' ' LYS . 8.1 t -95.41 -178.07 4.31 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.136 -1.214 . . . . 0.0 108.921 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.728 ' NZ ' HH21 ' A' ' 33' ' ' ARG . 31.7 tttp -47.76 120.84 3.62 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.553 ' HE ' HH22 ' A' ' 33' ' ' ARG . 9.5 mmt85 58.77 86.21 0.09 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.502 ' O ' ' N ' ' A' ' 31' ' ' CYS . . . -177.5 147.1 0.49 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.281 -0.887 . . . . 0.0 110.757 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.913 ' HA ' ' O ' ' A' ' 29' ' ' SER . 58.9 t90 -39.2 135.4 0.99 Allowed 'General case' 0 N--CA 1.499 2.025 0 CA-C-O 121.944 0.878 . . . . 0.0 112.165 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.959 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 17.9 p -132.02 157.98 42.71 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -95.26 -42.54 8.49 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.727 -1.233 . . . . 0.0 108.896 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 2.5 pt-20 -158.21 -170.23 3.05 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -61.52 -43.31 99.09 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 121.604 -0.685 . . . . 0.0 111.602 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -85.84 -19.43 30.65 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.683 -1.261 . . . . 0.0 112.09 -177.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.734 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 1.1 m-20 -73.15 -0.53 14.42 Favored 'General case' 0 C--N 1.303 -1.413 0 O-C-N 120.507 -1.371 . . . . 0.0 110.793 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.562 ' SG ' ' O ' ' A' ' 19' ' ' ASN . 20.6 m -90.58 144.29 25.91 Favored 'General case' 0 C--N 1.308 -1.205 0 O-C-N 120.492 -1.38 . . . . 0.0 109.221 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.564 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -55.06 125.1 19.06 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.382 -0.823 . . . . 0.0 109.494 -179.408 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.564 ' C ' ' O ' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -28.15 130.3 0.06 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.257 0.551 . . . . 0.0 109.975 -179.672 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.495 ' N ' ' OE2' ' A' ' 42' ' ' GLU . . . 103.02 -13.54 55.96 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.421 ' N ' ' OE2' ' A' ' 42' ' ' GLU . 46.2 m-85 -125.85 146.89 49.62 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.09 -1.241 . . . . 0.0 110.68 -179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.742 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 3.4 t30 -97.57 -166.86 1.44 Allowed 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.8 t -138.12 130.54 29.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.424 -0.797 . . . . 0.0 109.044 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.3 t -139.38 154.95 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.367 -0.833 . . . . 0.0 110.137 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -75.39 126.36 30.86 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.516 -0.74 . . . . 0.0 109.618 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -105.08 109.68 21.77 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.286 -0.884 . . . . 0.0 110.574 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.468 ' C ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p90 -57.39 -9.5 1.07 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.285 -0.884 . . . . 0.0 111.238 179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.437 ' HB3' ' ND2' ' A' ' 26' ' ' ASN . 15.4 t80 -59.78 -47.97 83.56 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.744 -1.223 . . . . 0.0 110.231 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.57 ' N ' ' ND2' ' A' ' 26' ' ' ASN . 0.0 OUTLIER -146.46 51.86 1.12 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.548 -1.345 . . . . 0.0 109.168 178.324 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.468 ' H ' ' NE2' ' A' ' 27' ' ' GLN . 26.5 mm-40 40.94 31.94 0.15 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.543 -0.723 . . . . 0.0 109.329 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.562 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -119.16 149.75 41.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 -179.829 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.913 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 8.1 m -89.03 160.19 17.21 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.297 -0.877 . . . . 0.0 109.173 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.473 ' HA ' ' O ' ' A' ' 6' ' ' ALA . 8.6 t -139.25 134.76 33.1 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.961 -1.087 . . . . 0.0 110.659 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.959 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 94.6 m -70.4 133.94 47.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.163 -0.961 . . . . 0.0 109.676 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -150.22 144.45 25.63 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.807 -1.183 . . . . 0.0 110.353 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.728 HH21 ' NZ ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -56.52 163.21 1.85 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.483 -0.761 . . . . 0.0 110.444 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.595 ' O ' ' N ' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -157.59 57.69 0.49 Allowed 'General case' 0 C--N 1.308 -1.238 0 O-C-N 120.796 -1.19 . . . . 0.0 110.594 179.234 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.655 ' CD1' ' N ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER 58.51 -76.36 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.983 -1.073 . . . . 0.0 110.336 178.237 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.655 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 1.4 mptp? 84.45 29.08 0.07 Allowed 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.14 0.495 . . . . 0.0 110.441 179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -108.13 54.92 0.65 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.248 -0.907 . . . . 0.0 108.654 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.73 HD12 ' H ' ' A' ' 40' ' ' THR . 0.2 OUTLIER -170.14 -150.52 0.08 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.469 -0.77 . . . . 0.0 108.947 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.466 ' O ' ' C ' ' A' ' 40' ' ' THR . 0.5 OUTLIER -57.6 -27.41 62.71 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.604 -1.31 . . . . 0.0 110.489 -179.643 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.73 ' H ' HD12 ' A' ' 38' ' ' LEU . 1.4 t 34.91 -112.93 0.07 Allowed 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.285 0.564 . . . . 0.0 110.298 -178.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.522 ' H ' HG23 ' A' ' 40' ' ' THR . . . 117.73 -20.35 10.96 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.495 ' OE2' ' N ' ' A' ' 17' ' ' GLY . 8.3 tm-20 -101.59 95.46 6.47 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.525 -0.985 . . . . 0.0 108.911 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.468 ' C ' ' O ' ' A' ' 42' ' ' GLU . 42.4 t . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.835 -1.078 . . . . 0.0 110.014 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 25.3 p . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.521 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -75.65 131.76 12.39 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 108.685 -1.766 . . . . 0.0 108.685 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 91.9 p -103.57 -145.23 0.37 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -1.081 . . . . 0.0 109.471 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -51.65 120.55 5.31 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.051 -1.031 . . . . 0.0 109.001 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.41 88.16 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.232 -0.918 . . . . 0.0 108.625 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -175.48 134.75 0.31 Allowed 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.717 0.77 . . . . 0.0 109.939 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.88 ' HA ' ' O ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -44.74 148.79 0.48 Allowed 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.984 0.897 . . . . 0.0 111.929 -179.099 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.684 ' HB3' ' SG ' ' A' ' 14' ' ' CYS . 0.1 OUTLIER -125.34 153.59 43.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.068 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 87.1 tttt -85.56 -33.69 21.66 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 9' ' ' LYS . 7.3 mm-40 -164.54 -173.04 2.89 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-O 121.492 0.663 . . . . 0.0 109.632 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.1 tttt -62.79 -48.67 78.13 Favored 'General case' 0 C--O 1.184 -2.351 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.57 ' HZ2' ' CB ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -87.17 2.75 48.96 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 118.471 -1.292 . . . . 0.0 109.528 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.569 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 49.0 m-20 -93.29 4.24 54.31 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.678 -0.639 . . . . 0.0 111.97 -178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.684 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 1.3 m -84.57 155.94 21.85 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 120.297 -1.502 . . . . 0.0 107.167 179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 2' ' ' GLY . 89.0 m -47.2 166.75 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.916 -1.115 . . . . 0.0 109.215 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.61 130.45 44.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.198 -0.939 . . . . 0.0 110.106 -178.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.793 ' O ' ' NE1' ' A' ' 35' ' ' TRP . . . 83.77 8.04 85.0 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.467 ' HA ' ' O ' ' A' ' 32' ' ' GLU . 61.4 m-85 -119.3 148.03 43.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.101 -1.235 . . . . 0.0 110.888 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 16.2 t30 -118.71 157.23 27.87 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.445 ' SG ' ' CB ' ' A' ' 29' ' ' SER . 16.0 t -91.22 132.47 36.09 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.934 -1.103 . . . . 0.0 110.739 -178.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -121.33 131.79 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -61.62 126.1 26.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.123 -0.985 . . . . 0.0 108.907 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -112.74 108.87 18.05 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.432 -0.793 . . . . 0.0 109.513 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.52 ' CG ' ' N ' ' A' ' 25' ' ' TYR . 5.9 p-90 -53.92 -39.16 65.6 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.102 -0.998 . . . . 0.0 109.324 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' N ' ' CG ' ' A' ' 24' ' ' TRP . 11.5 p90 -71.5 141.57 50.16 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.327 -0.949 . . . . 0.0 108.904 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.456 ' OD1' ' OE1' ' A' ' 28' ' ' GLN . 1.0 OUTLIER 70.22 -4.68 1.49 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -178.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.433 ' H ' ' C ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER 57.62 16.93 3.68 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.777 -0.824 . . . . 0.0 108.777 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.555 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 98.6 mt-30 -113.59 -172.06 2.01 Favored 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.548 -1.345 . . . . 0.0 108.55 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.88 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 50.1 m -121.01 138.43 54.17 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -103.31 139.8 38.26 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 121.424 -0.798 . . . . 0.0 111.234 -178.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 87.9 m -70.92 152.0 44.11 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.377 -0.827 . . . . 0.0 109.653 178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -147.57 -156.82 0.75 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.555 ' N ' ' OE1' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -156.85 126.73 6.3 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-O 122.316 1.055 . . . . 0.0 108.793 179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -127.98 24.46 6.02 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.793 ' NE1' ' O ' ' A' ' 17' ' ' GLY . 9.4 p-90 -119.35 -166.03 1.22 Allowed 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 -179.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.887 ' O ' ' HB2' ' A' ' 37' ' ' TYR . 24.7 tttt -172.06 39.59 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.071 -1.018 . . . . 0.0 109.709 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.887 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 11.5 m-85 108.06 32.96 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.449 0 C-N-CA 123.147 0.579 . . . . 0.0 109.589 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.754 ' O ' ' HB2' ' A' ' 39' ' ' PHE . 81.6 mt -62.06 -44.26 97.07 Favored 'General case' 0 C--N 1.308 -1.237 0 O-C-N 120.664 -1.273 . . . . 0.0 108.882 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.754 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER 139.19 -170.65 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.5 ' O ' ' C ' ' A' ' 41' ' ' GLY . 69.6 p -76.76 -0.86 25.32 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.312 -0.868 . . . . 0.0 109.503 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.5 ' C ' ' O ' ' A' ' 40' ' ' THR . . . -34.83 -80.1 0.02 OUTLIER Glycine 0 N--CA 1.495 2.603 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.513 ' CD ' ' H ' ' A' ' 42' ' ' GLU . 1.4 pm0 -108.05 117.4 34.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.33 -1.1 . . . . 0.0 109.407 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.41 ' HA ' ' H ' ' A' ' 17' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.304 -1.41 0 O-C-N 120.853 -1.155 . . . . 0.0 108.614 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.479 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 121.442 0.639 . . . . 0.0 109.78 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.489 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -68.43 -51.23 32.9 Favored Glycine 0 N--CA 1.495 2.594 0 O-C-N 121.382 -0.824 . . . . 0.0 113.436 -177.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.544 ' O ' ' C ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER 80.61 172.62 0.13 Allowed 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.075 -1.25 . . . . 0.0 110.244 -178.203 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.986 ' NZ ' ' HE ' ' A' ' 33' ' ' ARG . 46.4 tttp -28.77 129.56 0.07 Allowed 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.15 -0.969 . . . . 0.0 110.426 -178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 58.3 mtm-85 49.19 78.76 0.09 Allowed 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 -178.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 3' ' ' SER . . . -171.39 135.87 0.97 Allowed 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 118.324 -1.35 . . . . 0.0 111.138 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.644 ' HA ' ' O ' ' A' ' 29' ' ' SER . 23.3 t90 -51.43 136.42 25.64 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.651 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.586 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -123.22 147.85 46.46 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 178.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.58 ' HB3' ' OD2' ' A' ' 13' ' ' ASP . 16.0 ttpt -88.94 -46.96 8.49 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.915 -1.115 . . . . 0.0 108.486 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.425 ' H ' ' CB ' ' A' ' 13' ' ' ASP . 1.5 mm-40 -142.93 -179.36 6.31 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.483 ' CE ' ' OD1' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -61.61 -36.05 79.6 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.678 -1.264 . . . . 0.0 110.181 179.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 tttt -80.72 -8.55 59.69 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.031 -1.043 . . . . 0.0 109.993 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.58 ' OD2' ' HB3' ' A' ' 9' ' ' LYS . 24.3 t0 -85.01 0.22 52.18 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.813 -1.179 . . . . 0.0 110.894 -179.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.586 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 5.3 m -88.64 142.87 27.33 Favored 'General case' 0 C--N 1.309 -1.193 0 O-C-N 120.121 -1.612 . . . . 0.0 108.028 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 3' ' ' SER . 34.6 m -47.87 140.57 6.53 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.342 -0.849 . . . . 0.0 108.888 -179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.56 137.13 15.74 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.112 -0.993 . . . . 0.0 109.716 -178.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.44 -0.73 78.18 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.601 -1.4 . . . . 0.0 109.601 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -124.83 144.95 50.02 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.29 -1.124 . . . . 0.0 110.063 -179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.519 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 1.2 t30 -100.24 153.61 19.13 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.473 -0.767 . . . . 0.0 110.127 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 41.9 t -91.15 114.58 27.15 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.537 0.684 . . . . 0.0 109.245 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.569 ' O ' ' HA ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -97.06 142.84 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.605 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -103.12 127.13 50.51 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.191 -0.943 . . . . 0.0 109.533 -178.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -92.14 100.94 13.46 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.203 -0.936 . . . . 0.0 109.36 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.502 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 1.0 OUTLIER -44.14 -27.35 0.39 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.411 -0.806 . . . . 0.0 110.099 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' C ' ' H ' ' A' ' 27' ' ' GLN . 5.9 p90 -98.71 146.34 25.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.957 -1.089 . . . . 0.0 108.16 179.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 27' ' ' GLN . 1.1 m120 61.03 -3.43 0.16 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.359 -0.838 . . . . 0.0 109.348 -179.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.52 ' H ' ' C ' ' A' ' 25' ' ' TYR . 3.2 mp0 45.46 50.99 9.98 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.177 -0.952 . . . . 0.0 109.025 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.79 132.88 56.51 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.644 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 13.8 m -96.11 124.39 40.1 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 120.989 -1.069 . . . . 0.0 110.926 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.432 ' H ' HG12 ' A' ' 21' ' ' VAL . 1.2 p -105.5 118.67 37.15 Favored 'General case' 0 C--N 1.31 -1.147 0 O-C-N 121.273 -0.892 . . . . 0.0 109.792 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.7 m -65.72 142.87 57.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.741 -1.224 . . . . 0.0 108.923 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.414 ' O ' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -142.49 139.71 31.61 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.982 -1.074 . . . . 0.0 110.548 -179.97 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.986 ' HE ' ' NZ ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -63.97 60.31 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.858 -0.526 . . . . 0.0 112.152 179.779 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' N ' ' O ' ' A' ' 32' ' ' GLU . 1.1 mmmp? -54.64 -2.98 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.236 -1.54 . . . . 0.0 110.627 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.603 ' C ' ' H ' ' A' ' 37' ' ' TYR . 12.9 m95 -118.61 -174.03 2.6 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.033 -1.042 . . . . 0.0 110.301 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.659 ' O ' ' N ' ' A' ' 38' ' ' LEU . 21.7 mmmt -57.6 16.54 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.341 -0.85 . . . . 0.0 111.782 -178.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.603 ' H ' ' C ' ' A' ' 35' ' ' TRP . 1.3 p90 48.04 -3.95 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.218 -0.926 . . . . 0.0 112.052 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.659 ' N ' ' O ' ' A' ' 36' ' ' LYS . 2.6 mt -96.76 -65.32 0.97 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 120.369 -1.457 . . . . 0.0 110.046 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 178.51 -70.9 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.073 -1.017 . . . . 0.0 109.446 -178.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 58.88 77.05 0.32 Allowed 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 -179.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 75.11 178.22 41.49 Favored Glycine 0 N--CA 1.487 2.092 0 N-CA-C 108.848 -1.701 . . . . 0.0 108.848 -178.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -92.49 136.45 33.2 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.015 -1.285 . . . . 0.0 109.568 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.296 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.673 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.485 1.309 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.615 ' O ' ' HB3' ' A' ' 3' ' ' SER . . . -69.04 -59.19 6.06 Favored Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.793 -1.194 . . . . 0.0 110.925 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.615 ' HB3' ' O ' ' A' ' 2' ' ' GLY . 33.6 t 84.74 -165.28 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.785 -0.832 . . . . 0.0 110.549 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 18' ' ' TYR . 68.6 tttt -51.64 132.2 30.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.626 -0.671 . . . . 0.0 109.318 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.4 ttm180 53.37 78.6 0.14 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.433 ' HB1' ' CA ' ' A' ' 2' ' ' GLY . . . -178.09 129.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.985 -1.072 . . . . 0.0 110.78 -178.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.491 ' HA ' ' O ' ' A' ' 29' ' ' SER . 38.4 t90 -52.78 117.52 2.99 Favored 'General case' 0 C--N 1.307 -1.254 0 O-C-N 121.511 -0.743 . . . . 0.0 110.219 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.648 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -109.32 150.66 27.68 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 178.731 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -92.5 -35.02 13.84 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.511 -1.368 . . . . 0.0 109.423 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.648 ' O ' ' SG ' ' A' ' 8' ' ' CYS . 0.8 OUTLIER -159.22 -170.16 2.89 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 109.029 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.571 ' NZ ' ' NZ ' ' A' ' 36' ' ' LYS . 5.7 tptm -60.64 -48.52 81.4 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.903 -1.123 . . . . 0.0 109.43 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.8 tttm -69.84 -41.99 74.19 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.542 -0.724 . . . . 0.0 111.678 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HB3' ' H ' ' A' ' 10' ' ' GLU . 14.4 t70 -54.29 -14.78 1.28 Allowed 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.796 -1.19 . . . . 0.0 110.429 -178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.659 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 48.5 t -88.95 146.12 25.1 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.029 -1.044 . . . . 0.0 108.851 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.673 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.6 m -54.53 134.82 46.51 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.213 -178.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 123.96 16.23 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.25 -7.22 10.67 Favored Glycine 0 N--CA 1.484 1.864 0 N-CA-C 108.715 -1.754 . . . . 0.0 108.715 -179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.659 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 97.5 m-85 -125.38 150.98 46.73 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.386 -1.067 . . . . 0.0 110.807 -178.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.65 ' OD1' ' O ' ' A' ' 32' ' ' GLU . 9.3 p-10 -96.57 133.1 41.48 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.0 t -93.4 125.93 38.26 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.354 -0.841 . . . . 0.0 109.763 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 21' ' ' VAL . 3.2 p -119.54 114.12 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -81.33 112.73 18.9 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.771 ' HB3' HD21 ' A' ' 26' ' ' ASN . . . -84.43 89.95 7.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.021 -1.049 . . . . 0.0 109.641 -178.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.687 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -47.11 -22.1 0.32 Allowed 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.814 -0.554 . . . . 0.0 110.903 179.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.575 ' CD1' ' HB1' ' A' ' 23' ' ' ALA . 4.2 p90 -77.88 -45.18 24.96 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.516 -1.365 . . . . 0.0 111.267 -178.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.991 ' ND2' ' H ' ' A' ' 28' ' ' GLN . 0.1 OUTLIER -103.64 9.2 37.43 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 120.366 -1.458 . . . . 0.0 109.721 178.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.616 ' N ' HD22 ' A' ' 26' ' ' ASN . 99.0 mm-40 57.3 15.07 2.4 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.607 -0.683 . . . . 0.0 111.245 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.991 ' H ' ' ND2' ' A' ' 26' ' ' ASN . 77.4 mt-30 -119.07 138.66 52.72 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 120.961 -1.087 . . . . 0.0 109.909 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.491 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 4.3 m -96.2 131.16 42.97 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.032 -1.042 . . . . 0.0 109.612 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.3 t -117.43 104.15 10.82 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 121.439 -0.788 . . . . 0.0 109.957 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -64.59 153.92 37.83 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.833 -1.167 . . . . 0.0 110.056 -179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.65 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 94.6 mt-10 -144.12 137.3 27.4 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.363 -0.835 . . . . 0.0 110.177 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.626 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -73.13 85.35 1.35 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.509 ' HB2' ' CD1' ' A' ' 35' ' ' TRP . 17.2 mtpt -128.41 -24.16 3.11 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 119.97 -1.707 . . . . 0.0 108.959 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.642 ' O ' ' N ' ' A' ' 37' ' ' TYR . 5.9 m95 -121.59 -167.66 1.56 Allowed 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.442 -0.948 . . . . 0.0 108.442 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.571 ' NZ ' ' NZ ' ' A' ' 11' ' ' LYS . 2.3 mttm 36.05 24.13 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.818 -0.551 . . . . 0.0 110.02 178.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.673 ' O ' ' C ' ' A' ' 38' ' ' LEU . 8.7 t80 -101.04 -27.14 13.43 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.903 -1.123 . . . . 0.0 111.126 -178.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.673 ' C ' ' O ' ' A' ' 37' ' ' TYR . 0.1 OUTLIER 0.34 -119.72 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.24 0 CA-C-O 121.267 0.556 . . . . 0.0 110.614 -179.429 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -60.43 -44.25 95.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 120.657 -1.277 . . . . 0.0 109.775 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.807 HG23 ' H ' ' A' ' 41' ' ' GLY . 0.7 OUTLIER -153.89 -97.66 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.915 0 CA-C-O 121.217 0.532 . . . . 0.0 109.806 -179.146 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.807 ' H ' HG23 ' A' ' 40' ' ' THR . . . -106.62 -96.04 2.44 Favored Glycine 0 N--CA 1.494 2.548 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.697 ' HG3' ' O ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER 64.0 107.55 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.132 -1.216 . . . . 0.0 108.703 -179.483 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 O-C-N 120.708 -1.245 . . . . 0.0 109.644 -179.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.513 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 24.7 p . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.58 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -79.36 132.2 11.25 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.319 -1.419 . . . . 0.0 109.673 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.563 ' O ' ' HB2' ' A' ' 31' ' ' CYS . 6.7 p -111.37 -158.62 0.65 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.417 -1.049 . . . . 0.0 108.905 179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' A' ' 3' ' ' SER . 14.1 tttt -37.33 119.83 0.73 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.104 -0.998 . . . . 0.0 109.423 -179.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.411 ' N ' ' OE2' ' A' ' 32' ' ' GLU . 21.1 mtt180 50.74 87.55 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.463 ' HB3' ' N ' ' A' ' 3' ' ' SER . . . -172.23 131.52 0.62 Allowed 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.279 -0.968 . . . . 0.0 110.764 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.4 t90 -44.51 135.73 4.61 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.118 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.6 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -129.98 148.7 51.86 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.585 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -95.34 -43.46 8.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.791 -1.193 . . . . 0.0 109.492 178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.72 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 14.8 mt-10 -135.67 164.46 27.81 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.317 -0.864 . . . . 0.0 109.076 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.4 ttpt -55.59 -30.58 61.1 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.067 -1.021 . . . . 0.0 109.176 179.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.04 -8.33 51.76 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.992 -1.067 . . . . 0.0 109.436 179.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.632 ' CB ' ' H ' ' A' ' 10' ' ' GLU . 10.7 t70 -78.73 -3.6 45.07 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.89 -1.131 . . . . 0.0 110.152 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 7.5 m -85.78 141.29 29.78 Favored 'General case' 0 C--N 1.309 -1.155 0 O-C-N 120.623 -1.298 . . . . 0.0 107.958 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 62.3 m -49.03 144.76 4.52 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.165 -0.959 . . . . 0.0 109.702 -179.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -49.19 136.45 15.21 Favored 'General case' 0 C--O 1.166 -3.309 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.408 ' C ' ' HE1' ' A' ' 35' ' ' TRP . . . 95.82 -1.29 63.36 Favored Glycine 0 N--CA 1.491 2.36 0 C-N-CA 117.397 -2.335 . . . . 0.0 109.663 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -137.76 145.34 42.32 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.078 -1.248 . . . . 0.0 109.682 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.648 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 2.0 p-10 -103.21 176.43 5.15 Favored 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.549 1.166 . . . . 0.0 108.133 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.733 ' SG ' ' SG ' ' A' ' 14' ' ' CYS . 23.4 m -98.45 128.6 44.88 Favored 'General case' 0 N--CA 1.479 1.013 0 O-C-N 119.999 -1.688 . . . . 0.0 109.983 177.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' ' 30' ' ' SER . 2.2 t -122.16 120.39 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.529 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 9.3 t80 -78.28 120.3 22.85 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.321 -0.862 . . . . 0.0 109.105 -178.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -97.35 108.82 21.63 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.823 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 6.0 p90 -56.26 121.61 9.91 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.128 -0.983 . . . . 0.0 109.57 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.823 ' HB2' ' O ' ' A' ' 24' ' ' TRP . 2.5 t80 157.81 -79.56 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.053 -1.029 . . . . 0.0 109.203 178.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -110.21 22.68 15.26 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.437 -0.789 . . . . 0.0 109.742 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.529 ' OE1' ' OH ' ' A' ' 22' ' ' TYR . 52.0 mm-40 54.9 47.32 22.51 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.255 -0.903 . . . . 0.0 108.721 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -115.93 131.79 56.84 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.694 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 63.6 m -94.52 122.65 37.32 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.988 -1.07 . . . . 0.0 109.838 -179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.46 ' O ' ' HB ' ' A' ' 21' ' ' VAL . 30.6 p -97.12 113.99 25.62 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.021 -1.049 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.648 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 81.6 m -64.52 134.18 53.92 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.826 -1.172 . . . . 0.0 109.464 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.504 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 69.8 mm-40 -142.35 141.81 32.38 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.375 -0.828 . . . . 0.0 110.715 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.755 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -64.53 43.46 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.023 -1.048 . . . . 0.0 111.012 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 32' ' ' GLU . 12.3 mmtm -50.39 -9.46 0.05 OUTLIER 'General case' 0 C--N 1.292 -1.909 0 O-C-N 120.236 -1.54 . . . . 0.0 110.049 -179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.788 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -122.92 -150.02 0.44 Allowed 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.183 -0.948 . . . . 0.0 110.89 -179.922 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.788 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 72.5 mttt 112.85 10.37 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.469 0 C-N-CA 123.449 0.7 . . . . 0.0 110.195 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.465 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -132.54 10.5 4.39 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.638 -1.289 . . . . 0.0 111.117 -179.928 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.923 ' O ' ' N ' ' A' ' 40' ' ' THR . 13.5 tp -170.45 -120.2 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.448 0 O-C-N 120.53 -1.356 . . . . 0.0 110.34 179.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.523 ' O ' ' CB ' ' A' ' 40' ' ' THR . 34.6 m-85 32.48 -70.41 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.572 -0.705 . . . . 0.0 110.935 -179.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.923 ' N ' ' O ' ' A' ' 38' ' ' LEU . 0.2 OUTLIER 80.65 47.82 0.03 OUTLIER 'General case' 0 C--N 1.29 -1.989 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.385 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.628 ' O ' ' HG2' ' A' ' 42' ' ' GLU . . . -74.1 32.76 0.93 Allowed Glycine 0 N--CA 1.489 2.209 0 N-CA-C 110.019 -1.233 . . . . 0.0 110.019 -179.234 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 41' ' ' GLY . 2.0 pt-20 47.73 40.14 11.62 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.836 -0.802 . . . . 0.0 111.14 178.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 94.0 m . . . . . 0 C--N 1.298 -1.652 0 CA-C-O 118.001 -1.0 . . . . 0.0 109.769 179.783 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.524 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 14.7 p . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.11 0.481 . . . . 0.0 110.06 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.491 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -77.42 132.56 12.15 Favored Glycine 0 N--CA 1.488 2.1 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.678 ' O ' ' C ' ' A' ' 4' ' ' LYS . 83.2 p -120.94 148.1 44.54 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.306 -1.114 . . . . 0.0 108.598 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.678 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER 4.77 113.27 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.08 0 CA-C-O 121.454 0.645 . . . . 0.0 110.647 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.664 HH11 ' HB3' ' A' ' 5' ' ' ARG . 0.2 OUTLIER 60.22 87.15 0.09 Allowed 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.515 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 176.36 133.87 0.05 Allowed 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.248 -0.908 . . . . 0.0 110.114 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.781 ' HA ' ' O ' ' A' ' 29' ' ' SER . 24.3 t90 -51.44 130.05 26.58 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-O 121.505 0.669 . . . . 0.0 111.282 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.823 ' O ' ' HB2' ' A' ' 29' ' ' SER . 25.3 p -116.26 148.73 40.18 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.2 tttt -92.29 -46.19 7.83 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.408 -1.433 . . . . 0.0 109.123 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.526 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 1.3 mt-10 -154.11 -178.07 6.85 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -60.45 -43.53 96.77 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.596 -1.315 . . . . 0.0 109.755 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.7 mtmt -71.53 -9.76 58.71 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.764 -1.21 . . . . 0.0 110.876 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.526 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.6 OUTLIER -99.46 8.71 44.33 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.921 -1.112 . . . . 0.0 110.078 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.621 ' SG ' ' CB ' ' A' ' 18' ' ' TYR . 16.3 t -101.25 135.11 43.27 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.43 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 0.0 OUTLIER -56.83 145.2 30.3 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 120.938 -1.101 . . . . 0.0 109.982 -179.054 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 98.0 m -49.48 138.14 13.95 Favored 'General case' 1 C--O 1.152 -4.036 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.22 2.08 68.83 Favored Glycine 0 C--N 1.304 -1.243 0 N-CA-C 108.654 -1.778 . . . . 0.0 108.654 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.621 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 90.5 m-85 -137.11 149.39 47.3 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.503 -0.998 . . . . 0.0 110.545 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.649 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.5 p-10 -108.64 163.16 13.49 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.482 -0.762 . . . . 0.0 109.528 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.0 t -106.21 134.15 49.8 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.228 -0.92 . . . . 0.0 110.033 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 30' ' ' SER . 7.1 p -138.82 141.46 36.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.145 -0.972 . . . . 0.0 109.701 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -84.41 127.18 33.86 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.061 -1.024 . . . . 0.0 110.508 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -95.6 95.06 8.11 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.442 -0.787 . . . . 0.0 109.434 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.514 ' O ' ' NE2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -53.49 -40.55 65.45 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.415 -0.803 . . . . 0.0 110.766 -179.393 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.405 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 51.4 p90 -63.01 -46.37 87.97 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.604 -1.31 . . . . 0.0 110.488 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.462 ' C ' ' H ' ' A' ' 28' ' ' GLN . 12.7 m-20 -92.88 1.53 57.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 120.86 -1.15 . . . . 0.0 109.23 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.514 ' NE2' ' O ' ' A' ' 24' ' ' TRP . 99.4 mm-40 56.53 6.3 0.27 Allowed 'General case' 0 C--O 1.158 -3.754 0 CA-C-O 123.998 1.856 . . . . 0.0 111.771 179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.745 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 30.1 mt-30 -117.89 154.89 31.11 Favored 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 113.623 -1.626 . . . . 0.0 107.875 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.823 ' HB2' ' O ' ' A' ' 8' ' ' CYS . 5.8 m -91.07 159.54 16.07 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 120.95 -1.094 . . . . 0.0 110.175 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.686 ' O ' HG12 ' A' ' 21' ' ' VAL . 33.2 t -143.03 134.81 26.7 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 121.097 -1.002 . . . . 0.0 110.456 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.649 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 3.4 m -68.89 148.71 49.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.396 -0.815 . . . . 0.0 109.573 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.479 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 44.4 mm-40 -141.63 145.65 35.26 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.845 -1.159 . . . . 0.0 111.676 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.65 ' CD ' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -69.76 92.52 0.68 Allowed 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.09 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -111.24 0.67 16.83 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 120.289 -1.507 . . . . 0.0 108.604 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.792 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -119.57 178.35 4.59 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -179.59 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.792 ' HB2' ' O ' ' A' ' 35' ' ' TRP . 5.1 mmtt 103.55 22.64 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.688 ' O ' ' CB ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER -106.51 99.73 9.29 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.33 -0.856 . . . . 0.0 108.716 -179.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.688 ' CB ' ' O ' ' A' ' 37' ' ' TYR . 5.3 tp 133.97 -89.12 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 40' ' ' THR . 0.6 OUTLIER 179.41 34.64 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -179.807 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 39' ' ' PHE . 5.4 m -167.94 -118.18 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.205 -0.935 . . . . 0.0 109.332 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 115.15 151.04 9.94 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 108.718 -1.753 . . . . 0.0 108.718 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.479 ' O ' ' OXT' ' A' ' 43' ' ' CYS . 10.3 pt-20 -139.42 157.23 46.22 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.286 -1.126 . . . . 0.0 110.039 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.479 ' OXT' ' O ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 117.993 -1.003 . . . . 0.0 109.623 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' N ' ' A' ' 3' ' ' SER . 19.4 p . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 121.231 0.538 . . . . 0.0 109.83 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.498 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -53.86 89.11 0.01 OUTLIER Glycine 0 N--CA 1.489 2.227 0 N-CA-C 108.463 -1.855 . . . . 0.0 108.463 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.607 ' O ' ' O ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -110.95 104.0 12.54 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.246 -1.149 . . . . 0.0 109.479 -179.081 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.607 ' O ' ' O ' ' A' ' 3' ' ' SER . 33.5 tttt 49.39 108.96 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 CA-C-O 121.925 0.869 . . . . 0.0 109.205 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.595 ' HG3' ' HG2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 50.78 83.39 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.263 -0.898 . . . . 0.0 108.61 -178.84 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.93 120.54 0.06 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.326 -0.859 . . . . 0.0 109.335 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.777 ' HA ' ' O ' ' A' ' 29' ' ' SER . 9.8 t90 -48.95 142.35 6.65 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.491 -0.756 . . . . 0.0 111.482 -178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.462 ' N ' ' CD1' ' A' ' 7' ' ' TRP . 3.0 p -125.64 148.72 48.89 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.464 ' HB3' ' CB ' ' A' ' 13' ' ' ASP . 81.1 tttt -86.01 -28.18 24.35 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.093 -1.005 . . . . 0.0 108.832 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.776 ' HG3' ' H ' ' A' ' 11' ' ' LYS . 19.2 tp10 -170.28 -157.35 0.15 Allowed 'General case' 0 N--CA 1.489 1.509 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -178.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.776 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 6.3 tmtt? -69.39 -49.03 59.18 Favored 'General case' 0 N--CA 1.497 1.92 0 CA-C-O 121.356 0.598 . . . . 0.0 109.659 179.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.7 tttm -69.29 -45.56 69.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.298 -0.876 . . . . 0.0 110.441 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.549 ' O ' ' HA ' ' A' ' 1' ' ' CYS . 9.9 t70 -53.83 -9.05 0.2 Allowed 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.463 -0.773 . . . . 0.0 110.535 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.74 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -94.19 150.54 20.22 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.914 -1.116 . . . . 0.0 108.342 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.731 ' O ' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER -60.54 133.77 56.42 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.24 -0.913 . . . . 0.0 110.955 -178.379 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.687 ' N ' ' HB2' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -48.78 66.46 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 CA-C-O 121.533 0.682 . . . . 0.0 110.954 179.482 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.731 ' N ' ' O ' ' A' ' 15' ' ' CYS . . . 179.05 -29.17 0.06 OUTLIER Glycine 0 N--CA 1.486 2.025 0 N-CA-C 108.206 -1.958 . . . . 0.0 108.206 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.74 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 94.1 m-85 -108.29 153.75 22.79 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.707 -0.878 . . . . 0.0 110.19 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.712 ' C ' ' SG ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -101.83 134.09 45.55 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.55 -0.719 . . . . 0.0 109.263 179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 10' ' ' GLU . 43.7 t -80.52 121.51 25.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.985 -1.072 . . . . 0.0 109.938 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.685 HG23 ' OD1' ' A' ' 19' ' ' ASN . 41.4 t -126.55 132.56 70.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 -179.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.503 ' OH ' ' OE1' ' A' ' 27' ' ' GLN . 62.2 t80 -70.97 131.31 43.5 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 118.962 -1.095 . . . . 0.0 108.399 178.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 1.001 ' HB1' ' ND2' ' A' ' 26' ' ' ASN . . . -86.18 81.5 8.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 120.988 -1.07 . . . . 0.0 108.956 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.564 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -54.34 -36.83 64.22 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.272 -0.892 . . . . 0.0 111.123 -178.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.781 ' CE2' ' ND2' ' A' ' 26' ' ' ASN . 51.0 p90 -71.93 -27.08 62.57 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.648 -1.282 . . . . 0.0 110.997 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 1.001 ' ND2' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -133.56 13.13 4.11 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.776 -1.202 . . . . 0.0 109.121 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.987 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 79.4 mm-40 63.93 -163.41 0.26 Allowed 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.436 0.636 . . . . 0.0 110.724 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 59.93 -174.5 0.11 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.318 -0.864 . . . . 0.0 109.487 -178.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.777 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 3.2 m -132.67 121.77 23.64 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.235 -0.916 . . . . 0.0 108.856 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -114.62 113.28 24.16 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.218 -0.926 . . . . 0.0 109.966 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.712 ' SG ' ' C ' ' A' ' 19' ' ' ASN . 0.7 OUTLIER -67.01 146.51 54.28 Favored 'General case' 0 C--N 1.302 -1.466 0 C-N-CA 119.419 -0.913 . . . . 0.0 110.299 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 6.9 pt-20 -142.06 152.31 43.21 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.292 -0.88 . . . . 0.0 109.441 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.559 HH11 ' H ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -50.59 153.08 1.75 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.854 -179.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HB2' ' HB3' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -172.99 65.39 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.295 0 O-C-N 120.779 -1.201 . . . . 0.0 109.611 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.668 ' C ' ' H ' ' A' ' 37' ' ' TYR . 93.5 m95 -122.43 -31.24 3.82 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.156 -0.965 . . . . 0.0 110.195 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.465 ' H ' ' NH1' ' A' ' 33' ' ' ARG . 68.2 mttm 53.4 -9.78 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.615 -0.678 . . . . 0.0 111.145 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.668 ' H ' ' C ' ' A' ' 35' ' ' TRP . 66.3 m-85 -107.3 15.6 24.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.16 -0.963 . . . . 0.0 109.25 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.677 ' O ' ' C ' ' A' ' 39' ' ' PHE . 0.5 OUTLIER 76.01 -47.79 0.57 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.609 -0.682 . . . . 0.0 109.449 179.653 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.677 ' C ' ' O ' ' A' ' 38' ' ' LEU . 5.0 t80 -4.84 -93.99 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.734 -0.604 . . . . 0.0 111.078 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.444 HG22 ' CD1' ' A' ' 35' ' ' TRP . 43.6 p 38.39 -151.21 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.465 -0.772 . . . . 0.0 110.707 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.864 ' O ' ' O ' ' A' ' 42' ' ' GLU . . . 92.05 70.33 1.17 Allowed Glycine 0 N--CA 1.495 2.631 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.864 ' O ' ' O ' ' A' ' 41' ' ' GLY . 1.3 pm0 40.42 139.33 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.082 0 O-C-N 122.007 -0.702 . . . . 0.0 109.966 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.687 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.301 -1.53 0 O-C-N 120.534 -1.354 . . . . 0.0 108.792 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.563 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 15.8 p . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.558 ' O ' ' SG ' ' A' ' 15' ' ' CYS . . . -76.19 149.84 38.03 Favored Glycine 0 N--CA 1.494 2.518 0 C-N-CA 119.517 -1.325 . . . . 0.0 110.422 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.71 ' O ' ' N ' ' A' ' 5' ' ' ARG . 3.9 m -110.13 -162.57 0.81 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.275 -1.133 . . . . 0.0 109.861 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.779 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 3.6 tttm -58.53 54.23 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.5 -0.75 . . . . 0.0 110.327 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.71 ' N ' ' O ' ' A' ' 3' ' ' SER . 33.7 ptt-85 137.55 76.59 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.662 0.744 . . . . 0.0 109.144 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.416 ' HB3' ' H ' ' A' ' 3' ' ' SER . . . -175.0 146.77 0.89 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.187 -0.946 . . . . 0.0 110.512 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.75 ' HA ' ' O ' ' A' ' 29' ' ' SER . 35.1 t90 -47.83 151.11 0.95 Allowed 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.185 0.993 . . . . 0.0 111.746 -178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 31' ' ' CYS . 0.8 OUTLIER -121.98 153.58 38.35 Favored 'General case' 0 N--CA 1.497 1.916 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.047 -179.597 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -110.8 -29.51 7.94 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.992 -1.067 . . . . 0.0 109.057 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.579 ' HG2' ' H ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -168.79 -173.23 1.8 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.336 -0.852 . . . . 0.0 109.28 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.579 ' H ' ' HG2' ' A' ' 10' ' ' GLU . 6.6 ttmt -66.59 -49.45 66.3 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 120.199 -0.601 . . . . 0.0 112.187 -178.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -83.95 -10.81 57.66 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.476 -1.39 . . . . 0.0 109.054 -179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.496 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 50.3 m-20 -71.78 -3.88 24.58 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.89 179.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.804 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 30.5 t -85.56 149.62 25.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.872 -1.142 . . . . 0.0 108.773 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.563 ' SG ' ' O ' ' A' ' 1' ' ' CYS . 64.7 m -57.05 147.65 23.71 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.352 -0.843 . . . . 0.0 109.324 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -52.32 134.15 34.11 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.396 -0.815 . . . . 0.0 109.225 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.464 ' N ' ' HB3' ' A' ' 43' ' ' CYS . . . 94.47 -0.99 66.12 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.625 ' CB ' ' SG ' ' A' ' 14' ' ' CYS . 79.7 m-85 -134.17 150.25 51.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.234 -1.156 . . . . 0.0 110.55 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.04 150.82 25.38 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 178.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.804 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 2.8 m -94.0 138.27 32.28 Favored 'General case' 0 N--CA 1.403 -2.823 1 O-C-N 116.281 -4.012 . . . . 0.0 109.931 175.494 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.1 t -135.12 137.96 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.447 -0.783 . . . . 0.0 110.824 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.4 103.83 1.39 Allowed 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.696 ' O ' ' C ' ' A' ' 24' ' ' TRP . . . -93.76 -161.74 0.88 Allowed 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.696 ' C ' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER 14.07 94.93 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.577 0 CA-C-O 121.95 0.881 . . . . 0.0 109.47 -178.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -49.26 3.42 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.68 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.905 ' H ' HD22 ' A' ' 26' ' ' ASN . 0.1 OUTLIER -81.34 -56.03 4.32 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.277 -0.889 . . . . 0.0 108.824 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.746 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER 172.72 37.53 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 122.224 1.011 . . . . 0.0 108.652 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.514 ' HB3' ' HB2' ' A' ' 24' ' ' TRP . 56.4 tp60 -121.57 157.38 30.86 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.586 -1.321 . . . . 0.0 110.547 -179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.75 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 2.6 m -133.32 150.57 51.86 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.1 t -143.5 136.44 27.65 Favored 'General case' 0 C--N 1.309 -1.185 0 O-C-N 121.078 -1.013 . . . . 0.0 110.529 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.671 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 1.5 m -67.09 144.36 56.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.448 -0.783 . . . . 0.0 109.641 179.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -148.17 139.07 23.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.313 -0.867 . . . . 0.0 109.553 179.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.739 ' NE ' ' HE1' ' A' ' 35' ' ' TRP . 0.7 OUTLIER -57.94 175.41 0.2 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.121 -0.987 . . . . 0.0 109.384 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.545 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER 178.54 99.36 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.351 0 O-C-N 120.623 -1.298 . . . . 0.0 109.925 179.763 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.739 ' HE1' ' NE ' ' A' ' 33' ' ' ARG . 7.7 p-90 -120.15 167.96 11.71 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.586 -0.696 . . . . 0.0 109.673 178.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 35' ' ' TRP . 0.3 OUTLIER 80.29 -9.77 1.35 Allowed 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 -179.149 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.771 ' O ' ' HB2' ' A' ' 38' ' ' LEU . 32.4 p90 -73.21 49.28 0.26 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.382 -0.824 . . . . 0.0 109.377 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.771 ' HB2' ' O ' ' A' ' 37' ' ' TYR . 72.7 mt 96.39 137.04 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.88 43.73 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.591 -0.693 . . . . 0.0 110.031 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.633 ' N ' ' O ' ' A' ' 38' ' ' LEU . 16.1 p -74.77 166.48 23.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.499 -1.376 . . . . 0.0 109.463 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -56.26 -175.05 0.21 Allowed Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -137.46 165.68 25.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -1.097 . . . . 0.0 109.456 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.464 ' HB3' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 O-C-N 121.25 -0.906 . . . . 0.0 109.016 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.564 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 22.0 p . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.645 ' O ' ' SG ' ' A' ' 31' ' ' CYS . . . -76.6 122.61 6.41 Favored Glycine 0 N--CA 1.486 2.014 0 C-N-CA 118.669 -1.729 . . . . 0.0 108.929 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.697 ' O ' ' C ' ' A' ' 4' ' ' LYS . 14.9 m -98.97 175.21 6.0 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.016 -1.285 . . . . 0.0 108.148 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.697 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.0 OUTLIER -25.72 128.38 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 179.176 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.484 ' HB3' ' O ' ' A' ' 4' ' ' LYS . 14.4 ttp180 60.33 82.19 0.16 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.224 -0.923 . . . . 0.0 109.134 -178.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 5' ' ' ARG . . . 176.44 129.02 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.226 -0.921 . . . . 0.0 110.582 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.585 ' HA ' ' O ' ' A' ' 29' ' ' SER . 2.0 t90 -44.66 133.25 6.04 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-O 121.572 0.701 . . . . 0.0 110.565 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.713 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 27.6 p -114.12 135.23 54.26 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -90.03 -37.04 14.57 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.618 -1.301 . . . . 0.0 109.487 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.54 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 0.2 OUTLIER -146.37 177.85 8.7 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.3 -0.875 . . . . 0.0 108.846 178.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -61.4 -45.5 94.09 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-O 121.328 0.585 . . . . 0.0 110.074 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 pttp -81.06 -15.52 55.83 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 119.667 -1.895 . . . . 0.0 112.214 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.54 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -71.81 -7.79 50.41 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.105 -0.997 . . . . 0.0 111.243 -178.286 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.51 ' SG ' ' CB ' ' A' ' 8' ' ' CYS . 51.3 m -88.13 142.79 27.48 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 120.446 -1.409 . . . . 0.0 107.758 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.503 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 0.1 OUTLIER -53.09 148.97 7.27 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.542 -178.523 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.617 ' HA ' ' HB3' ' A' ' 43' ' ' CYS . 0.0 OUTLIER -49.17 120.19 3.82 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-O 122.134 0.968 . . . . 0.0 109.746 -178.851 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.94 -1.27 35.74 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.594 -1.403 . . . . 0.0 109.594 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 4' ' ' LYS . 82.7 m-85 -131.15 144.82 51.67 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.449 -1.03 . . . . 0.0 108.587 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 9.2 p-10 -118.31 169.08 10.03 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.028 -1.045 . . . . 0.0 110.333 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.1 t -89.45 128.42 35.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.667 -0.645 . . . . 0.0 109.436 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.5 t -127.71 130.74 70.29 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 121.367 -0.833 . . . . 0.0 109.459 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -72.79 118.38 15.65 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.181 -0.949 . . . . 0.0 109.066 -179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -89.94 95.16 10.1 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.412 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 1.8 p-90 -52.87 -40.46 63.45 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.523 -0.736 . . . . 0.0 110.517 -178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.642 ' O ' ' ND2' ' A' ' 26' ' ' ASN . 0.4 OUTLIER -73.9 136.56 43.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.854 -1.154 . . . . 0.0 108.606 179.873 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 25' ' ' TYR . 0.2 OUTLIER 55.95 13.22 1.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.28 -0.888 . . . . 0.0 109.07 -178.389 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 2.0 mp0 50.51 -155.53 0.12 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.408 -0.808 . . . . 0.0 109.888 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.946 HE21 ' H ' ' A' ' 29' ' ' SER . 1.7 tp60 63.56 144.04 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.261 -0.899 . . . . 0.0 110.062 -179.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.946 ' H ' HE21 ' A' ' 28' ' ' GLN . 70.6 m -100.9 157.03 17.03 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.334 178.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.6 t -136.69 139.06 41.69 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.233 -0.917 . . . . 0.0 110.653 -179.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.713 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 91.3 m -66.87 148.24 52.2 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.494 ' O ' ' OD1' ' A' ' 19' ' ' ASN . 4.6 pt-20 -144.25 139.69 28.79 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.972 -1.08 . . . . 0.0 108.982 178.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.534 ' NH1' ' NE1' ' A' ' 35' ' ' TRP . 3.9 ttm180 -64.21 155.01 33.15 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.311 -0.868 . . . . 0.0 110.735 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -159.59 70.88 0.47 Allowed 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.608 ' O ' ' CD1' ' A' ' 35' ' ' TRP . 0.2 OUTLIER -112.36 131.07 55.73 Favored 'General case' 0 C--N 1.289 -2.06 0 CA-C-O 122.321 1.057 . . . . 0.0 110.036 -179.479 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER -60.14 -36.08 76.72 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.994 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.674 ' CG ' ' O ' ' A' ' 37' ' ' TYR . 42.3 t80 155.89 27.9 0.0 OUTLIER 'General case' 0 C--N 1.29 -1.994 0 CA-C-N 115.192 -0.913 . . . . 0.0 108.632 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.96 HD22 ' N ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -177.97 -175.77 0.51 Allowed 'General case' 0 N--CA 1.484 1.258 0 O-C-N 121.222 -0.924 . . . . 0.0 109.866 179.899 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.96 ' N ' HD22 ' A' ' 38' ' ' LEU . 48.4 m-85 -32.1 120.6 0.29 Allowed 'General case' 0 N--CA 1.499 2.021 0 CA-C-O 121.702 0.763 . . . . 0.0 111.528 -178.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -81.71 34.47 0.39 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.273 -0.892 . . . . 0.0 109.237 178.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 73.91 -134.61 18.96 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 109.065 -1.614 . . . . 0.0 109.065 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -137.71 154.14 49.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.155 -1.203 . . . . 0.0 109.577 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.617 ' HB3' ' HA ' ' A' ' 16' ' ' CYS . 8.5 p . . . . . 0 C--N 1.303 -1.444 0 CA-C-O 118.008 -0.996 . . . . 0.0 109.618 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.733 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.674 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -73.57 150.17 42.9 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.808 -1.317 . . . . 0.0 109.808 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.464 ' O ' ' C ' ' A' ' 4' ' ' LYS . 50.2 m -105.26 -170.2 1.71 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.355 -1.085 . . . . 0.0 109.505 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.464 ' C ' ' O ' ' A' ' 3' ' ' SER . 0.6 OUTLIER -37.52 121.84 0.89 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.219 -0.925 . . . . 0.0 109.91 -179.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.612 ' N ' ' O ' ' A' ' 31' ' ' CYS . 42.5 ttp180 48.89 86.05 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 178.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.476 ' O ' ' C ' ' A' ' 7' ' ' TRP . . . -173.03 124.23 0.42 Allowed 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 121.975 0.893 . . . . 0.0 109.668 -178.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.714 ' HA ' ' O ' ' A' ' 29' ' ' SER . 34.7 t90 -24.54 142.67 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.21 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.678 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.7 OUTLIER -130.95 157.08 43.91 Favored 'General case' 0 N--CA 1.502 2.153 0 CA-C-O 121.731 0.777 . . . . 0.0 110.574 179.379 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 10' ' ' GLU . 30.5 mttm -88.49 -40.82 13.16 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 177.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.52 ' H ' ' HB2' ' A' ' 13' ' ' ASP . 51.1 mm-40 -159.41 -173.65 4.28 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 121.541 0.686 . . . . 0.0 109.173 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.584 ' HG3' ' OD1' ' A' ' 19' ' ' ASN . 53.5 tttm -67.94 -45.82 73.2 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.363 -0.836 . . . . 0.0 109.986 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.77 -12.83 60.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.529 -0.732 . . . . 0.0 110.099 -178.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.52 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 12.4 m-20 -85.4 2.58 43.82 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.045 -1.034 . . . . 0.0 111.549 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 8' ' ' CYS . 3.8 m -85.38 143.38 28.67 Favored 'General case' 0 C--N 1.308 -1.237 0 O-C-N 120.428 -1.42 . . . . 0.0 108.408 179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.733 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 11.0 m -54.56 138.92 39.69 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.323 -0.861 . . . . 0.0 108.708 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' C ' ' O ' ' A' ' 15' ' ' CYS . 44.4 t -34.12 148.49 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.509 ' CA ' ' HB3' ' A' ' 43' ' ' CYS . . . 74.94 1.38 62.53 Favored Glycine 0 N--CA 1.493 2.44 0 C-N-CA 119.758 -1.211 . . . . 0.0 111.3 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.706 ' HB3' ' HB3' ' A' ' 31' ' ' CYS . 62.8 m-85 -135.93 156.57 48.57 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.5 -1.589 . . . . 0.0 111.157 -179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 1.055 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 32.1 t30 -131.05 169.24 16.13 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.537 -0.727 . . . . 0.0 110.391 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 29' ' ' SER . 6.3 t -90.35 109.08 20.2 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.915 -1.116 . . . . 0.0 109.94 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.679 HG21 ' CD ' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -103.58 134.22 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 O-C-N 121.493 -0.754 . . . . 0.0 109.797 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.536 ' CD2' ' O ' ' A' ' 23' ' ' ALA . 65.4 t80 -67.91 141.49 56.35 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.044 -1.035 . . . . 0.0 108.966 179.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 27' ' ' GLN . . . -85.52 -148.82 0.12 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.299 -0.876 . . . . 0.0 110.01 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.416 ' CZ3' ' O ' ' A' ' 22' ' ' TYR . 0.8 OUTLIER -175.01 -49.0 0.01 OUTLIER 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.253 -179.336 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.579 ' CE1' ' ND2' ' A' ' 26' ' ' ASN . 4.2 p90 -86.78 -34.29 19.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.61 -1.307 . . . . 0.0 108.375 179.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.872 ' H ' HD22 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -109.57 10.34 25.09 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.478 -0.764 . . . . 0.0 109.361 178.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.57 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 98.6 mm-40 54.59 -167.22 0.08 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.101 -0.999 . . . . 0.0 110.77 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.6 tp60 64.06 -168.36 0.21 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.537 -0.727 . . . . 0.0 109.274 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.714 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 58.9 m -131.84 147.15 52.46 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.365 -0.834 . . . . 0.0 109.441 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.8 p -128.37 143.11 50.96 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 1.055 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 77.7 m -67.63 148.08 51.85 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.006 -1.059 . . . . 0.0 109.874 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.679 ' CD ' HG21 ' A' ' 21' ' ' VAL . 0.7 OUTLIER -147.71 149.7 32.93 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.117 -0.989 . . . . 0.0 110.275 179.463 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -59.79 135.51 57.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.625 -1.297 . . . . 0.0 109.26 -179.11 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -87.35 0.72 55.02 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 121.241 -0.912 . . . . 0.0 111.877 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.611 ' O ' ' HG2' ' A' ' 36' ' ' LYS . 5.4 m95 54.26 -167.97 0.07 Allowed 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 -177.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 35' ' ' TRP . 50.0 mmtt -164.81 -41.12 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.884 -1.135 . . . . 0.0 108.977 177.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.563 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 59.0 t80 173.66 -21.14 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.205 179.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -164.55 -158.35 0.41 Allowed 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.217 -0.927 . . . . 0.0 110.32 -179.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -55.79 -44.13 77.47 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.233 -0.917 . . . . 0.0 109.893 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.403 HG22 ' N ' ' A' ' 41' ' ' GLY . 88.8 m -71.47 155.67 40.32 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 121.335 -0.853 . . . . 0.0 108.779 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.403 ' N ' HG22 ' A' ' 40' ' ' THR . . . 134.72 17.3 0.95 Allowed Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -95.47 126.01 40.47 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.151 -1.205 . . . . 0.0 108.708 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.509 ' HB3' ' CA ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.599 -179.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.649 ' HB2' ' N ' ' A' ' 15' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 121.171 0.51 . . . . 0.0 109.689 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.573 ' C ' ' HB3' ' A' ' 6' ' ' ALA . . . -59.51 -89.99 0.02 OUTLIER Glycine 0 N--CA 1.494 2.513 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.287 -178.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' A' ' 2' ' ' GLY . 1.3 t 87.13 -173.78 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.683 -0.893 . . . . 0.0 110.54 -178.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.597 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 71.5 tttt -43.66 126.64 4.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.569 -0.707 . . . . 0.0 109.842 -178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.597 ' HG2' ' HG2' ' A' ' 4' ' ' LYS . 0.4 OUTLIER 46.92 81.26 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 -177.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HB3' ' C ' ' A' ' 2' ' ' GLY . . . -178.81 126.78 0.1 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.242 -177.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.81 ' HA ' ' O ' ' A' ' 29' ' ' SER . 31.8 t90 -52.77 137.74 30.85 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.662 0.744 . . . . 0.0 111.692 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.707 ' SG ' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -122.03 170.98 9.3 Favored 'General case' 1 N--CA 1.539 4.005 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.478 178.405 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.707 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -121.98 -36.8 2.94 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.521 -1.362 . . . . 0.0 108.041 177.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.728 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 44.6 mt-10 -148.36 169.51 20.0 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.03 -1.471 . . . . 0.0 107.03 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 tptm -59.05 -23.77 62.28 Favored 'General case' 0 C--N 1.292 -1.893 0 O-C-N 121.076 -1.015 . . . . 0.0 108.72 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 52.6 tttm -93.33 -33.98 13.69 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.612 -0.68 . . . . 0.0 111.282 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.472 ' HB2' ' H ' ' A' ' 10' ' ' GLU . 0.2 OUTLIER -63.74 -6.98 6.41 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.006 -1.059 . . . . 0.0 110.58 -178.237 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.745 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.4 t -93.96 160.77 14.58 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.497 -0.752 . . . . 0.0 108.998 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.649 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 94.1 m -56.78 140.0 49.14 Favored 'General case' 0 C--N 1.306 -1.312 0 O-C-N 120.985 -1.072 . . . . 0.0 109.108 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -57.43 129.31 41.24 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.174 -0.954 . . . . 0.0 109.462 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.508 ' O ' ' CD1' ' A' ' 35' ' ' TRP . . . 104.0 -4.14 45.26 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.93 ' C ' ' HE1' ' A' ' 35' ' ' TRP . 95.3 m-85 -117.99 141.18 48.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.942 -1.328 . . . . 0.0 109.32 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.835 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 5.3 p-10 -90.91 144.03 26.1 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.323 -0.86 . . . . 0.0 108.739 -179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.728 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 18.0 m -90.31 136.29 33.14 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.576 0.703 . . . . 0.0 111.253 -178.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.437 ' O ' ' HA ' ' A' ' 29' ' ' SER . 41.9 t -117.25 101.48 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -73.85 114.46 12.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.338 -0.851 . . . . 0.0 109.42 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.783 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -94.93 88.81 5.4 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.279 -0.888 . . . . 0.0 110.506 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.621 ' CD1' ' N ' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -51.86 -2.05 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.384 -0.823 . . . . 0.0 109.941 178.489 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.588 ' H ' ' C ' ' A' ' 23' ' ' ALA . 0.2 OUTLIER -60.37 -49.31 78.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.083 -1.011 . . . . 0.0 109.637 -179.047 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.555 ' ND2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -151.27 46.75 0.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.234 -0.916 . . . . 0.0 109.286 179.464 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 52.28 37.95 23.54 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.466 -0.771 . . . . 0.0 110.165 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.783 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 8.3 tt0 -120.36 114.14 21.4 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.21 -0.931 . . . . 0.0 109.513 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.81 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 15.7 m -95.24 172.37 8.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.948 -1.095 . . . . 0.0 109.277 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 20' ' ' CYS . 1.6 t -144.56 -157.81 0.82 Allowed 'General case' 0 C--N 1.307 -1.255 0 O-C-N 121.236 -0.915 . . . . 0.0 109.849 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.835 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -165.73 138.49 4.21 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.018 -179.729 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -145.2 144.25 30.74 Favored 'General case' 0 N--CA 1.496 1.857 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.71 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 1.1 ptp85 -57.57 110.27 0.85 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.151 -0.968 . . . . 0.0 111.45 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -155.12 56.3 0.65 Allowed 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.405 -1.332 . . . . 0.0 107.405 178.143 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.93 ' HE1' ' C ' ' A' ' 18' ' ' TYR . 39.9 m95 -114.01 -13.05 12.53 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.577 -0.702 . . . . 0.0 111.347 -178.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.445 ' C ' ' O ' ' A' ' 35' ' ' TRP . 0.0 OUTLIER 42.01 9.87 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.222 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.214 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.741 ' N ' ' O ' ' A' ' 35' ' ' TRP . 67.5 m-85 -106.47 47.7 0.87 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.957 -1.09 . . . . 0.0 109.042 -179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.24 -33.24 74.21 Favored 'General case' 0 C--N 1.304 -1.371 0 O-C-N 121.504 -0.748 . . . . 0.0 109.215 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -53.99 -45.3 71.39 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.451 -0.78 . . . . 0.0 109.089 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.506 HG22 ' H ' ' A' ' 42' ' ' GLU . 14.6 m -76.39 161.42 28.7 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -117.39 10.18 14.78 Favored Glycine 0 N--CA 1.499 2.838 0 C-N-CA 119.843 -1.17 . . . . 0.0 110.719 -179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.506 ' H ' HG22 ' A' ' 40' ' ' THR . 13.4 pt-20 -138.08 -177.78 4.98 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.948 -1.325 . . . . 0.0 109.321 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.302 -1.499 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.289 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.503 ' O ' ' SG ' ' A' ' 1' ' ' CYS . 19.4 p . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.626 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -88.41 114.7 4.27 Favored Glycine 0 N--CA 1.489 2.203 0 C-N-CA 119.41 -1.376 . . . . 0.0 109.892 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 4' ' ' LYS . 3.6 m -94.31 -159.52 0.71 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.142 -1.211 . . . . 0.0 107.736 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 5' ' ' ARG . 11.6 tmtt? -46.9 147.54 1.31 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.426 -1.421 . . . . 0.0 108.286 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 5' ' ' ARG . 8.1 ptm180 39.2 78.59 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.563 1.173 . . . . 0.0 109.286 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.71 125.96 0.08 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.442 -0.787 . . . . 0.0 109.266 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.694 ' HA ' ' O ' ' A' ' 29' ' ' SER . 72.5 t90 -45.06 134.1 6.19 Favored 'General case' 0 N--CA 1.494 1.759 0 CA-C-O 121.578 0.704 . . . . 0.0 111.729 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -123.83 136.03 54.13 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.474 ' HB3' ' CG ' ' A' ' 13' ' ' ASP . 31.0 tttm -82.73 -40.87 19.97 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.656 ' HG2' ' N ' ' A' ' 11' ' ' LYS . 62.8 tt0 -156.55 179.58 9.12 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.656 ' N ' ' HG2' ' A' ' 10' ' ' GLU . 1.6 ttpm? -58.87 -43.96 90.96 Favored 'General case' 0 C--N 1.285 -2.214 0 C-N-CA 119.244 -0.982 . . . . 0.0 108.874 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -69.63 -37.79 76.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.358 -0.839 . . . . 0.0 110.582 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.474 ' CG ' ' HB3' ' A' ' 9' ' ' LYS . 10.3 t70 -60.34 -23.47 64.27 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.779 -1.201 . . . . 0.0 110.577 -178.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.3 t -79.56 142.96 35.24 Favored 'General case' 0 C--N 1.298 -1.647 0 O-C-N 121.024 -1.048 . . . . 0.0 108.833 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.473 ' O ' ' C ' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -51.47 121.95 7.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.835 0.826 . . . . 0.0 109.429 -177.759 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' C ' ' O ' ' A' ' 15' ' ' CYS . 1.3 t -38.1 137.79 0.49 Allowed 'General case' 0 C--N 1.302 -1.497 0 CA-C-O 121.274 0.559 . . . . 0.0 109.523 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.614 ' N ' ' SG ' ' A' ' 43' ' ' CYS . . . 100.79 -14.24 58.96 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 67.7 m-85 -111.23 150.47 29.53 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.994 -1.298 . . . . 0.0 110.312 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.628 ' O ' ' HA ' ' A' ' 31' ' ' CYS . 4.9 t30 -97.46 132.24 43.35 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.442 -0.787 . . . . 0.0 109.93 -178.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.724 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 5.3 m -85.94 143.01 28.41 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.276 -0.89 . . . . 0.0 109.863 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 30' ' ' SER . 0.3 OUTLIER -134.61 143.57 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.625 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -109.94 111.78 23.38 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.027 -1.046 . . . . 0.0 108.717 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.636 ' O ' ' N ' ' A' ' 27' ' ' GLN . . . -89.64 93.36 9.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.914 -1.116 . . . . 0.0 109.264 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -54.23 -38.14 65.4 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.403 179.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.611 ' N ' ' CD1' ' A' ' 24' ' ' TRP . 0.0 OUTLIER -60.37 -46.65 89.2 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.947 -1.096 . . . . 0.0 108.931 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.401 ' C ' ' H ' ' A' ' 28' ' ' GLN . 81.1 m-20 -92.45 -6.75 49.27 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.191 -0.943 . . . . 0.0 108.8 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.636 ' N ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER 58.72 6.48 0.62 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.432 -0.793 . . . . 0.0 109.474 -179.831 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.401 ' H ' ' C ' ' A' ' 26' ' ' ASN . 29.1 mm100 -109.99 137.19 48.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.346 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.694 ' O ' ' HA ' ' A' ' 7' ' ' TRP . 20.4 m -93.82 144.5 25.37 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.083 -1.011 . . . . 0.0 108.427 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.477 ' O ' HG12 ' A' ' 21' ' ' VAL . 13.6 p -142.93 127.98 18.51 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.372 -0.83 . . . . 0.0 109.776 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.628 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -69.85 160.45 31.77 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.342 -0.849 . . . . 0.0 110.545 -179.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -145.18 141.28 28.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.541 -0.724 . . . . 0.0 109.057 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.455 ' O ' ' HG2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -70.19 128.94 37.99 Favored 'General case' 0 C--N 1.282 -2.349 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.594 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 33' ' ' ARG . 94.5 mttt -158.2 27.13 0.25 Allowed 'General case' 0 C--N 1.303 -1.431 0 O-C-N 120.856 -1.152 . . . . 0.0 109.855 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.454 ' C ' ' N ' ' A' ' 37' ' ' TYR . 88.9 m95 -116.86 -1.43 12.02 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.291 -0.88 . . . . 0.0 109.752 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.25 -10.92 0.09 Allowed 'General case' 0 C--N 1.296 -1.718 0 O-C-N 121.75 -0.594 . . . . 0.0 109.814 -178.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.454 ' N ' ' C ' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -112.73 41.49 2.04 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.485 HD22 ' HA ' ' A' ' 38' ' ' LEU . 0.2 OUTLIER -145.62 153.7 41.33 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.184 -0.947 . . . . 0.0 108.682 179.724 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.529 ' O ' ' C ' ' A' ' 40' ' ' THR . 44.3 t80 -46.34 114.44 0.8 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.132 -0.98 . . . . 0.0 108.981 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.529 ' C ' ' O ' ' A' ' 39' ' ' PHE . 9.9 m 31.8 -117.43 0.05 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-O 121.323 0.583 . . . . 0.0 110.173 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.543 ' C ' ' HG2' ' A' ' 42' ' ' GLU . . . -159.31 -29.65 0.02 OUTLIER Glycine 0 N--CA 1.485 1.948 0 C-N-CA 119.97 -1.11 . . . . 0.0 110.348 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.543 ' HG2' ' C ' ' A' ' 41' ' ' GLY . 1.6 pm0 35.54 67.7 0.26 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.243 -1.151 . . . . 0.0 108.912 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.614 ' SG ' ' N ' ' A' ' 17' ' ' GLY . 0.1 OUTLIER . . . . . 0 C--N 1.301 -1.519 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.355 -178.597 . . . . . . . . 2 2 . 1 stop_ save_