data_1tr6_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 1tr6 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.6 p . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -134.5 -177.11 4.46 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.436 ' C ' ' H ' ' A' ' 5' ' ' GLY . 50.0 m . . . . . 0 N--CA 1.501 2.076 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.604 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.436 ' H ' ' C ' ' A' ' 3' ' ' SER . . . . . . . . 0 N--CA 1.485 1.918 0 N-CA-C 109.225 -1.55 . . . . 0.0 109.225 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 t -64.96 138.16 58.19 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.5 m -65.32 91.14 0.11 Allowed 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.381 1.05 . . . . 0.0 113.015 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -89.6 -152.69 0.25 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.203 -1.362 . . . . 0.0 107.542 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.439 ' HG ' ' H ' ' A' ' 10' ' ' LYS . 35.8 t -162.16 -120.0 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.439 ' H ' ' HG ' ' A' ' 9' ' ' SER . 0.3 OUTLIER -110.32 -42.23 4.19 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.8 p -89.76 -21.13 22.8 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.273 0.983 . . . . 0.0 111.706 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -72.56 94.96 1.76 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 123.741 0.651 . . . . 0.0 110.583 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -103.42 21.84 15.28 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.654 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -77.94 21.11 0.33 Allowed 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.325 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.8 m -96.15 125.82 40.94 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -63.05 -29.54 70.9 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 119.532 1.06 . . . . 0.0 108.213 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.6 tpt85 -89.35 -85.53 0.2 Allowed 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.1 p -174.66 167.62 3.77 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.836 0.71 . . . . 0.0 109.489 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.2 t -102.42 117.38 34.61 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.403 1.261 . . . . 0.0 114.403 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.446 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 46.2 t30 . . . . . 0 N--CA 1.497 1.908 0 O-C-N 124.433 1.083 . . . . 0.0 108.621 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 . . . . . 0 N--CA 1.498 1.949 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.4 p -108.87 -4.1 17.1 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 113.668 -1.605 . . . . 0.0 109.872 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 53.78 26.2 5.81 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -132.89 161.04 35.27 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 112.506 -2.133 . . . . 0.0 109.893 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.8 m -75.35 141.92 43.25 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 123.659 0.6 . . . . 0.0 112.147 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 80.9 m-85 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.983 0.897 . . . . 0.0 109.749 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.4 p . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 121.223 0.535 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.447 ' NZ ' ' HB3' ' A' ' 2' ' ' LYS . 3.3 mmmp? -107.56 -177.43 3.35 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.624 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.2 p . . . . . 0 N--CA 1.501 2.105 0 O-C-N 123.448 0.468 . . . . 0.0 111.245 -179.886 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.466 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 110.627 -0.989 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.472 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 69.9 m -67.96 136.57 54.14 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 120.925 0.393 . . . . 0.0 111.656 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.2 m -57.25 93.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.4 p -142.75 127.8 18.5 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.443 ' HG ' ' N ' ' A' ' 10' ' ' LYS . 32.4 t -59.85 171.75 0.87 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.381 -179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.443 ' N ' ' HG ' ' A' ' 9' ' ' SER . 5.6 tmtt? -41.22 -66.16 0.36 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-N 114.063 -1.426 . . . . 0.0 108.595 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 68.5 p -90.04 65.79 6.62 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.084 0.865 . . . . 0.0 111.791 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 m -143.19 25.92 1.69 Allowed 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 114.542 -1.208 . . . . 0.0 107.803 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.435 ' HH ' ' HD3' ' A' ' 10' ' ' LYS . 62.4 m-85 -55.62 94.59 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.619 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -147.26 0.17 0.7 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.815 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 45.5 m -72.6 168.07 19.39 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.982 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.7 m -64.2 -29.62 70.72 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -108.65 -83.75 0.55 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 113.39 -1.732 . . . . 0.0 106.931 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.469 ' OG ' ' CD1' ' A' ' 27' ' ' TYR . 33.1 p -175.63 -175.18 0.75 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 123.965 0.79 . . . . 0.0 108.915 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.484 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 98.8 m -106.97 100.52 10.01 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.752 0 CA-C-N 112.249 -2.251 . . . . 0.0 108.934 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.6 p90 . . . . . 0 N--CA 1.499 2.008 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 31.3 m -144.05 -7.62 0.72 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt 47.66 36.8 5.92 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.271 0.982 . . . . 0.0 108.931 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.501 ' HG3' ' N ' ' A' ' 26' ' ' CYS . 10.2 ptt-85 -128.79 -174.68 3.32 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.705 -2.702 . . . . 0.0 103.705 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.501 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 97.3 m -91.32 140.72 29.51 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 118.941 0.791 . . . . 0.0 109.211 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.469 ' CD1' ' OG ' ' A' ' 18' ' ' SER . 19.6 m-85 . . . . . 0 N--CA 1.498 1.971 0 CA-C-O 121.63 0.729 . . . . 0.0 110.299 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.461 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 29.3 p . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.461 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 34.8 mmtp -143.32 175.45 9.89 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.496 1.853 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.853 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.454 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.483 1.786 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.481 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 32.9 t -65.35 145.28 56.38 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.2 p -72.31 103.55 3.44 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.584 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 18.7 t -122.74 147.88 45.98 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.184 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.9 m -98.21 -76.29 0.53 Allowed 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.319 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -143.4 -54.66 0.38 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 124.222 0.951 . . . . 0.0 111.037 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -89.43 -5.31 57.5 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.584 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 59.2 m -75.64 87.48 2.72 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -72.1 18.84 0.08 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 114.36 -1.291 . . . . 0.0 113.15 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.439 ' H ' ' C ' ' A' ' 12' ' ' SER . 9.1 m-80 -69.43 -2.64 11.6 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.064 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.8 m -96.83 115.88 28.2 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 22.3 m -69.48 -23.92 63.71 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.559 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -89.24 -83.69 0.23 Allowed 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.1 p -175.37 168.14 3.3 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.896 0.747 . . . . 0.0 109.942 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 73.1 m -95.81 116.4 28.85 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.436 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.2 p90 . . . . . 0 N--CA 1.503 2.223 0 CA-C-O 122.25 1.024 . . . . 0.0 110.639 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 54.6 m -150.11 -20.96 0.25 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.929 -1.941 . . . . 0.0 106.989 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 49.75 41.51 22.23 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 124.363 1.039 . . . . 0.0 108.497 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -147.59 163.41 36.69 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.481 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 62.1 m -84.83 144.65 28.3 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.46 -0.896 . . . . 0.0 109.346 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 121.928 0.87 . . . . 0.0 110.869 179.591 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.8 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 110.629 -0.137 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.476 ' HD3' ' H ' ' A' ' 3' ' ' SER . 1.8 tmtm? -104.48 146.34 29.01 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.476 ' H ' ' HD3' ' A' ' 2' ' ' LYS . 49.2 m . . . . . 0 N--CA 1.501 2.099 0 O-C-N 123.674 0.608 . . . . 0.0 111.606 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.426 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 49.6 m -81.93 152.28 26.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 54.9 m -63.85 98.48 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.508 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 42.5 t -89.45 103.89 16.49 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.2 m -80.86 -152.32 0.09 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.487 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -22.2 50.35 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.903 179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.4 p -97.71 149.24 22.51 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 m -136.3 9.19 3.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 123.665 0.603 . . . . 0.0 110.807 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -62.37 -17.55 59.29 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.179 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -65.76 -55.72 15.78 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.144 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 75.4 m -95.36 140.42 30.26 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.081 0.863 . . . . 0.0 112.405 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.1 m -66.98 -11.73 57.68 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -89.59 -121.99 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 p -164.49 -174.89 3.63 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.9 m -81.33 109.5 15.89 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 117.705 2.483 . . . . 0.0 117.705 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.479 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 179.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.7 p90 . . . . . 0 N--CA 1.502 2.133 0 CA-C-O 122.206 1.003 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.4 p -150.14 -17.33 0.25 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.036 -1.893 . . . . 0.0 107.919 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mttp 56.44 33.19 22.04 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -140.74 178.67 7.18 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.548 -2.569 . . . . 0.0 108.581 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 74.1 m -85.49 167.17 15.7 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 . . . . . 0 N--CA 1.493 1.685 0 CA-C-O 122.33 1.062 . . . . 0.0 110.863 179.689 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.573 0.701 . . . . 0.0 112.111 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -100.95 153.89 19.14 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.789 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.497 1.887 0 O-C-N 124.07 0.856 . . . . 0.0 109.921 179.921 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.476 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.486 1.99 0 N-CA-C 111.695 -0.562 . . . . 0.0 111.695 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.485 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 34.2 t -70.18 133.38 47.03 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.2 t -68.8 109.1 3.7 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 20.9 p -148.9 149.3 31.02 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 114.761 -1.109 . . . . 0.0 113.267 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 80.3 p -62.48 176.01 0.7 Allowed 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 113.553 -1.658 . . . . 0.0 113.793 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.99 -36.49 49.94 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.1 p -88.62 -139.31 0.12 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 46.3 t 49.97 73.59 0.25 Allowed 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.521 0.677 . . . . 0.0 109.37 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -81.88 40.51 0.61 Allowed 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.422 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -91.59 7.75 39.97 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.995 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 69.6 m -90.87 134.92 34.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 123.571 0.544 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 64.2 m -57.62 -28.19 63.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 -103.82 -85.53 0.46 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 36.3 p 179.28 166.32 1.02 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.659 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 79.5 m -91.68 113.62 25.94 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.49 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.547 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 p90 . . . . . 0 N--CA 1.504 2.244 0 CA-C-O 122.44 1.114 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.402 ' CG2' ' HB3' ' A' ' 20' ' ' ASN . 8.4 t -150.72 -16.33 0.23 Allowed 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 113.002 -1.908 . . . . 0.0 107.671 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt 50.31 44.53 26.5 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 122.727 1.251 . . . . 0.0 107.701 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 92.0 mtt-85 -150.14 158.1 43.81 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 110.963 -2.835 . . . . 0.0 108.559 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.485 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 74.1 m -76.3 138.03 40.26 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.751 -0.779 . . . . 0.0 110.434 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.436 ' CE1' ' HA ' ' A' ' 20' ' ' ASN . 84.1 m-85 . . . . . 0 N--CA 1.497 1.875 0 CA-C-O 121.927 0.87 . . . . 0.0 112.101 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.456 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 21.3 p . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -89.79 164.91 14.46 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.495 1.813 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.321 -179.948 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.407 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.486 1.994 0 CA-C-O 119.002 -0.888 . . . . 0.0 111.755 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.622 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 23.4 m -63.46 140.85 58.91 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-N 117.818 0.809 . . . . 0.0 109.49 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.6 m -59.94 95.07 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.482 1.114 . . . . 0.0 113.544 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.441 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 42.9 t -150.38 154.47 37.83 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.003 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.0 m -145.01 54.85 1.22 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.054 -1.43 . . . . 0.0 108.83 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.506 ' H ' ' CB ' ' A' ' 19' ' ' CYS . 32.3 mmmt 68.94 42.36 1.32 Allowed 'General case' 0 N--CA 1.504 2.237 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.413 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 66.1 p -140.42 26.71 2.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 113.444 -1.707 . . . . 0.0 110.752 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.441 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 42.9 t -152.8 -52.53 0.11 Allowed 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 57.58 12.44 1.55 Allowed 'General case' 0 N--CA 1.503 2.183 0 O-C-N 124.505 1.128 . . . . 0.0 111.768 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -75.82 -42.12 50.72 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.323 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.622 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 87.6 m -49.29 144.55 5.23 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 115.999 1.851 . . . . 0.0 115.999 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.456 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 35.0 m -54.63 -42.79 71.66 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 112.44 -2.164 . . . . 0.0 110.861 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.409 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -89.79 -91.72 0.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.3 p -171.81 179.29 2.8 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.506 ' CB ' ' H ' ' A' ' 10' ' ' LYS . 80.1 m -96.09 115.75 27.91 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.408 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 . . . . . 0 N--CA 1.504 2.264 0 CA-C-O 122.129 0.966 . . . . 0.0 108.671 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.424 ' HG1' ' H ' ' A' ' 25' ' ' ARG . 41.6 p -119.6 -9.01 9.88 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 112.873 -1.967 . . . . 0.0 107.624 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt 51.45 26.57 3.25 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.81 1.319 . . . . 0.0 108.321 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.424 ' H ' ' HG1' ' A' ' 23' ' ' THR . 8.1 ptm180 -133.54 177.99 7.27 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 103.864 -2.643 . . . . 0.0 103.864 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.407 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 89.2 m -95.39 153.46 17.68 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.759 0.79 . . . . 0.0 109.467 179.728 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.1 p . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 121.184 0.516 . . . . 0.0 111.746 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -116.3 168.23 10.32 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.732 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.4 p . . . . . 0 N--CA 1.497 1.906 0 CA-C-N 114.448 -1.251 . . . . 0.0 112.31 179.984 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.965 0 CA-C-O 119.684 -0.509 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.5 t -69.02 152.82 44.77 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.3 m -74.29 104.42 5.05 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 117.866 2.543 . . . . 0.0 117.866 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.626 ' SG ' ' N ' ' A' ' 12' ' ' SER . 2.2 t -88.9 137.94 31.86 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.6 t -77.74 78.53 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.9 tttp 63.53 -70.14 0.07 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 113.046 -1.888 . . . . 0.0 110.656 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.1 p -125.32 27.9 6.46 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 123.327 0.392 . . . . 0.0 111.923 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.626 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 90.2 p -68.45 107.17 2.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -74.47 82.54 1.96 Allowed 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.9 p30 -147.09 5.57 0.85 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 112.754 -2.021 . . . . 0.0 109.882 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 72.9 m -95.35 128.25 42.05 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.292 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 67.5 m -55.09 -30.66 60.14 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.5 mmm-85 -90.58 -94.08 0.12 Allowed 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 104.821 -2.289 . . . . 0.0 104.821 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 p -177.83 176.09 1.24 Allowed 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.484 ' SG ' ' O ' ' A' ' 12' ' ' SER . 75.3 m -90.66 106.32 18.42 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 116.16 1.911 . . . . 0.0 116.16 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.409 HD21 ' H ' ' A' ' 23' ' ' THR . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 106.341 -1.725 . . . . 0.0 106.341 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 . . . . . 0 N--CA 1.503 2.21 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.409 ' H ' HD21 ' A' ' 20' ' ' ASN . 41.4 p -121.25 5.72 10.24 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 112.872 -1.967 . . . . 0.0 109.122 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.13 30.93 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.472 0 O-C-N 125.34 1.65 . . . . 0.0 113.117 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.403 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 15.2 ptm180 -127.32 -168.02 1.82 Allowed 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 112.042 -2.345 . . . . 0.0 105.539 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.5 m -95.34 152.39 18.42 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.614 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 122.195 0.998 . . . . 0.0 111.236 179.508 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.172 0.51 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -84.93 160.25 20.15 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.955 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.0 m . . . . . 0 N--CA 1.496 1.826 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.437 -179.918 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.869 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.3 m -78.76 135.93 37.25 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.9 t -55.18 91.79 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 124.532 1.145 . . . . 0.0 113.609 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.448 ' H ' ' HA ' ' A' ' 25' ' ' ARG . 28.4 p -92.1 -169.46 2.26 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.092 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.0 m -143.22 -50.71 0.34 Allowed 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.019 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.424 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 5.6 ttpm? -167.55 -47.76 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.968 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 t -89.61 68.04 7.6 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.149 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -88.77 39.46 0.92 Allowed 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 114.496 -1.229 . . . . 0.0 113.743 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -62.06 -24.09 66.88 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -57.82 -43.4 85.71 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 114.259 -1.337 . . . . 0.0 108.858 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.5 m -83.75 138.12 33.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 124.526 1.141 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.21 -22.14 65.69 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 123.776 0.672 . . . . 0.0 110.883 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -89.44 -111.81 0.07 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 124.075 0.859 . . . . 0.0 108.814 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.9 p -163.79 -156.35 0.35 Allowed 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 117.751 -1.118 . . . . 0.0 109.173 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.5 t -117.19 109.89 17.47 Favored 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 . . . . . 0 N--CA 1.494 1.77 0 CA-C-N 114.902 -1.044 . . . . 0.0 108.241 179.696 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 . . . . . 0 N--CA 1.502 2.168 0 CA-C-O 122.053 0.93 . . . . 0.0 109.008 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.4 p -139.1 -9.29 1.31 Allowed 'General case' 0 N--CA 1.492 1.636 0 CA-C-N 113.016 -1.902 . . . . 0.0 108.896 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.417 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 7.0 mtpm? 49.34 29.21 2.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.771 1.294 . . . . 0.0 108.469 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HA ' ' H ' ' A' ' 8' ' ' CYS . 5.6 ptp180 -130.33 170.22 14.43 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -77.0 152.83 35.03 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 N--CA 1.492 1.647 0 C-N-CA 119.767 -0.773 . . . . 0.0 109.312 179.597 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.531 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 2.5 mppt? -92.32 157.55 16.58 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.417 ' N ' ' HG ' ' A' ' 6' ' ' SER . 54.0 m . . . . . 0 N--CA 1.502 2.126 0 O-C-N 123.23 0.331 . . . . 0.0 111.433 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.928 0 N-CA-C 108.706 -1.758 . . . . 0.0 108.706 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.417 ' HG ' ' N ' ' A' ' 3' ' ' SER . 70.1 m -65.99 143.35 57.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.8 t -50.64 96.41 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 O-C-N 125.355 1.66 . . . . 0.0 114.455 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.517 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 47.9 t -140.71 149.42 42.17 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.588 0.709 . . . . 0.0 111.494 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.1 m -151.8 -65.03 0.18 Allowed 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.412 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 3.8 mmmp? -148.43 19.75 1.06 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 124.847 1.342 . . . . 0.0 109.061 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -114.87 -63.18 1.49 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 123.648 0.593 . . . . 0.0 111.635 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.517 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 49.3 m -62.95 143.56 57.61 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 123.915 0.759 . . . . 0.0 109.161 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -67.42 21.98 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.8 m120 68.17 115.51 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.35 1.071 . . . . 0.0 113.887 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 2' ' ' LYS . 72.2 m -57.54 170.49 0.54 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.312 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 99.0 m -53.22 -20.89 4.5 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.587 -0.445 . . . . 0.0 112.026 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -89.52 -76.22 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.407 ' OG ' ' CD2' ' A' ' 27' ' ' TYR . 30.6 p 175.19 178.4 0.15 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 124.641 1.213 . . . . 0.0 109.612 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -104.91 120.56 41.73 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.495 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.259 0 O-C-N 123.957 0.786 . . . . 0.0 109.74 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 50.8 p90 . . . . . 0 N--CA 1.504 2.237 0 CA-C-O 121.791 0.805 . . . . 0.0 112.23 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.3 m -136.16 -11.58 1.94 Allowed 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 106.252 -1.759 . . . . 0.0 106.252 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm 53.29 31.86 12.53 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.413 ' HA ' ' H ' ' A' ' 8' ' ' CYS . 81.4 mtt85 -148.84 178.05 9.0 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.808 -1.996 . . . . 0.0 110.478 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.0 m -95.94 -178.49 4.37 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.407 ' CD2' ' OG ' ' A' ' 18' ' ' SER . 73.3 m-85 . . . . . 0 N--CA 1.489 1.486 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.548 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.424 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 17.1 p . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 121.276 0.56 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -94.9 165.41 12.47 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.602 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p . . . . . 0 N--CA 1.496 1.833 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.542 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.47 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.488 2.14 0 CA-C-O 119.576 -0.569 . . . . 0.0 113.564 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.0 t -64.94 133.29 51.46 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.7 p -63.84 84.51 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 23.0 p -126.83 123.95 38.51 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.367 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.5 p -34.44 -101.53 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 118.423 2.749 . . . . 0.0 118.423 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.07 -34.42 0.23 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 118.396 0.544 . . . . 0.0 111.827 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -89.58 -10.33 46.47 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.47 1.106 . . . . 0.0 110.463 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.1 m -59.21 -65.26 0.7 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.538 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.426 ' N ' ' SG ' ' A' ' 19' ' ' CYS . 36.3 m-85 55.2 19.39 2.87 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 124.064 0.852 . . . . 0.0 110.182 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -58.87 -34.88 72.12 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 92.0 m -69.23 151.01 46.81 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.424 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 46.9 m -44.17 -39.55 4.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 125.557 1.786 . . . . 0.0 108.686 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -89.81 -94.15 0.11 Allowed 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 105.569 -2.012 . . . . 0.0 105.569 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.7 p -171.26 176.36 3.93 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 119.391 0.996 . . . . 0.0 112.691 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.426 ' SG ' ' N ' ' A' ' 13' ' ' TYR . 80.5 m -106.22 112.15 25.06 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 123.939 0.775 . . . . 0.0 113.066 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.44 HD21 ' CG2' ' A' ' 23' ' ' THR . 60.6 t30 . . . . . 0 N--CA 1.496 1.843 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.095 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.9 p90 . . . . . 0 N--CA 1.506 2.361 0 CA-C-O 123.035 1.398 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.44 ' CG2' HD21 ' A' ' 20' ' ' ASN . 7.8 t -150.9 -13.04 0.22 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 111.653 -2.522 . . . . 0.0 106.471 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? 38.79 41.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 125.241 1.588 . . . . 0.0 110.958 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HG2' ' CG2' ' A' ' 23' ' ' THR . 9.2 ptm180 -139.2 164.22 30.38 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 102.978 -2.971 . . . . 0.0 102.978 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 89.4 m -75.7 165.4 25.11 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 118.51 -1.276 . . . . 0.0 113.183 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.488 1.443 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.181 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.0 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.475 0.655 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -89.18 179.85 6.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.967 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.6 p . . . . . 0 N--CA 1.496 1.851 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.633 -179.967 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.416 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 67.5 m -64.12 133.3 52.72 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.6 p -58.31 89.04 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 O-C-N 124.947 1.404 . . . . 0.0 114.309 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 38.1 t -89.38 145.74 25.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.828 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.1 p -100.45 46.86 0.94 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp 65.56 -2.37 0.85 Allowed 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.945 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.8 p -143.32 80.46 1.67 Allowed 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.651 0.738 . . . . 0.0 110.805 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.488 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 39.4 t -159.54 82.91 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -76.17 5.17 7.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 114.044 -1.435 . . . . 0.0 110.67 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.422 ' H ' HD21 ' A' ' 14' ' ' ASN . 6.6 m-80 -55.3 -39.52 70.0 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.372 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.416 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 76.2 m -71.14 150.79 45.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.788 0.68 . . . . 0.0 109.904 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 94.3 m -58.56 -35.98 73.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 123.684 0.615 . . . . 0.0 112.142 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -89.73 -101.68 0.1 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 117.808 -1.091 . . . . 0.0 111.523 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.9 p -166.37 -171.73 2.01 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 119.636 1.107 . . . . 0.0 112.152 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 88.7 m -96.39 114.43 26.1 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.459 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 49.5 p90 . . . . . 0 N--CA 1.501 2.102 0 CA-C-O 122.35 1.071 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.4 ' HG1' ' ND2' ' A' ' 20' ' ' ASN . 59.1 m -143.71 -7.81 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HZ3' HH12 ' A' ' 25' ' ' ARG . 24.1 pttm 37.71 34.32 0.05 Allowed 'General case' 0 N--CA 1.507 2.396 0 CA-C-O 122.811 1.291 . . . . 0.0 111.563 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.436 HH12 ' HZ3' ' A' ' 24' ' ' LYS . 81.2 mtt85 -142.31 170.86 14.91 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 111.391 -2.64 . . . . 0.0 108.694 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.5 m -84.89 157.76 20.79 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.36 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 . . . . . 0 N--CA 1.49 1.552 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.58 179.438 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.7 p . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.397 0.618 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -84.53 177.64 8.02 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.57 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.494 1.726 0 CA-C-N 115.032 -0.985 . . . . 0.0 113.079 -179.78 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.4 t -56.67 144.51 32.03 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.4 m -66.12 86.09 0.1 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.461 ' SG ' ' OG ' ' A' ' 12' ' ' SER . 37.3 t -89.85 120.14 30.83 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.668 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.7 t -124.02 63.18 1.07 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt 79.66 -49.03 0.38 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-N 112.939 -1.937 . . . . 0.0 109.925 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 70.0 p -89.59 107.97 19.39 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 123.848 0.718 . . . . 0.0 110.992 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.461 ' OG ' ' SG ' ' A' ' 8' ' ' CYS . 89.6 p -169.19 3.94 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.605 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 56.35 22.0 5.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 123.685 0.616 . . . . 0.0 111.083 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 42.6 t30 63.01 106.21 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.153 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.3 m -59.5 166.17 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.959 -1.473 . . . . 0.0 109.52 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.0 m -36.19 -43.63 0.36 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 124.234 0.959 . . . . 0.0 112.362 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -101.83 -96.78 0.28 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 107.543 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -168.7 147.28 4.13 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 75.7 m -66.8 143.64 56.78 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.916 -1.947 . . . . 0.0 113.506 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.7 t30 . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 179.673 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 . . . . . 0 N--CA 1.499 1.988 0 N-CA-C 103.995 -2.594 . . . . 0.0 103.995 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.7 p -90.01 -10.18 45.86 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.445 -1.707 . . . . 0.0 107.52 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 51.97 33.58 12.05 Favored 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -141.11 152.01 44.41 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 110.742 -2.935 . . . . 0.0 109.464 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.6 m -83.47 -178.27 7.0 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.615 0.722 . . . . 0.0 110.108 179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 . . . . . 0 C--N 1.303 -1.438 0 CA-C-N 114.087 -1.415 . . . . 0.0 107.606 179.641 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.45 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 14.2 p . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 121.02 0.438 . . . . 0.0 112.176 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.404 ' HB2' ' NZ ' ' A' ' 2' ' ' LYS . 10.1 mtmp? -83.69 -179.08 7.22 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.188 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 N--CA 1.495 1.816 0 CA-C-N 115.019 -0.991 . . . . 0.0 112.28 -179.902 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.002 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.464 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 61.3 m -64.08 134.04 54.17 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 51.6 m -60.6 90.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 124.696 1.247 . . . . 0.0 114.161 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 28.3 p -149.33 168.28 23.8 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.246 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -169.77 164.02 9.89 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 113.909 -1.496 . . . . 0.0 110.531 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp 48.99 -99.65 0.06 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -89.34 78.72 7.17 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.98 0.895 . . . . 0.0 109.649 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.408 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 59.4 m -155.05 116.11 3.97 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -135.45 84.56 2.1 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -140.1 -48.75 0.45 Allowed 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.779 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 92.9 m -57.51 141.66 46.96 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.45 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.3 m -46.46 -33.7 4.19 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 113.006 -1.906 . . . . 0.0 110.634 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -99.26 -93.34 0.26 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.0 p -174.59 -178.19 1.3 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 76.7 m -98.8 109.28 22.06 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.513 HD21 ' H ' ' A' ' 23' ' ' THR . 6.6 t30 . . . . . 0 N--CA 1.499 1.998 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.613 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.412 ' HB2' HD22 ' A' ' 20' ' ' ASN . 72.3 m-85 . . . . . 0 N--CA 1.502 2.146 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.513 ' H ' HD21 ' A' ' 20' ' ' ASN . 74.7 p -90.99 -9.72 44.96 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.835 -1.53 . . . . 0.0 107.556 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 54.69 28.45 10.11 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -139.05 166.52 24.28 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 111.253 -2.703 . . . . 0.0 108.501 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 90.4 m -79.23 154.76 28.96 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 . . . . . 0 N--CA 1.49 1.543 0 CA-C-N 113.442 -1.708 . . . . 0.0 110.566 179.889 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.569 0.699 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.08 147.44 23.72 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 113.655 -1.611 . . . . 0.0 107.775 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 57.5 m . . . . . 0 N--CA 1.498 1.932 0 O-C-N 124.293 0.996 . . . . 0.0 112.359 -179.909 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 CA-C-O 119.438 -0.646 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.459 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 33.1 t -65.06 140.13 58.8 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.2 m -63.59 91.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -106.71 126.24 52.03 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.41 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.5 m -140.71 84.86 1.96 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 124.158 0.911 . . . . 0.0 110.932 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? 52.8 25.94 4.2 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.411 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -145.66 -43.49 0.21 Allowed 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 m -85.0 57.55 4.51 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -80.38 80.64 6.79 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.478 1.133 . . . . 0.0 108.207 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 p30 -162.3 15.34 0.08 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.889 -1.959 . . . . 0.0 109.87 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 81.9 m -65.23 126.31 27.77 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.1 m -45.0 -39.69 5.81 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -94.66 -83.33 0.35 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.7 p -176.62 170.62 2.41 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.813 0.696 . . . . 0.0 110.838 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 87.3 m -94.24 112.67 24.49 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.503 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.882 0 CA-C-N 114.539 -1.209 . . . . 0.0 107.797 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.2 p90 . . . . . 0 N--CA 1.505 2.308 0 CA-C-O 122.704 1.24 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.0 p -150.11 -15.54 0.25 Allowed 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 112.368 -2.197 . . . . 0.0 107.59 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp 50.3 31.93 5.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 124.399 1.062 . . . . 0.0 109.261 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -136.43 173.38 11.77 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.459 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 73.7 m -89.32 149.12 23.18 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.972 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 20' ' ' ASN . 82.7 m-85 . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 121.983 0.897 . . . . 0.0 110.247 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 120.787 0.327 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -97.1 165.45 12.06 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.498 1.962 0 O-C-N 123.777 0.673 . . . . 0.0 110.843 179.959 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.43 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.486 2.0 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.9 t -74.12 147.21 42.91 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.3 t -66.13 96.33 0.32 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 124.327 1.017 . . . . 0.0 108.972 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.6 p -89.62 165.44 14.24 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.388 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.8 m -66.64 -69.32 0.31 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.848 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -164.32 -39.84 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.852 0.72 . . . . 0.0 109.294 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -142.8 23.78 1.89 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.111 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.0 t -55.43 111.71 0.95 Allowed 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.455 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -69.59 -8.09 44.34 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.802 -1.545 . . . . 0.0 111.596 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -58.49 -32.85 69.17 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.834 0.709 . . . . 0.0 109.652 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.4 m -57.23 129.78 43.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 124.204 0.94 . . . . 0.0 111.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.7 m -51.3 -41.41 60.48 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -93.75 -80.81 0.38 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.785 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 p -174.11 176.13 2.59 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 123.973 0.796 . . . . 0.0 109.643 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.5 t -97.31 111.15 23.53 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -179.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.57 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 1.1 t-20 . . . . . 0 N--CA 1.498 1.968 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.637 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 . . . . . 0 N--CA 1.498 1.954 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.8 p -97.97 6.15 48.02 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 113.93 -1.486 . . . . 0.0 109.442 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.2 pttm 41.93 31.8 0.25 Allowed 'General case' 0 N--CA 1.51 2.562 0 CA-C-O 123.589 1.662 . . . . 0.0 110.007 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -136.42 -178.54 5.21 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 110.514 -3.039 . . . . 0.0 107.643 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.43 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 81.0 m -85.86 144.62 27.6 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.405 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.57 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 65.9 m-85 . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 121.912 0.863 . . . . 0.0 109.892 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.438 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 10.8 p . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -71.84 159.7 33.84 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.363 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.497 1.901 0 O-C-N 123.803 0.69 . . . . 0.0 111.415 -179.849 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.131 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.2 m -53.14 123.28 11.33 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.1 p -67.18 80.58 0.13 Allowed 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.709 1.256 . . . . 0.0 113.952 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 5.9 p -109.85 120.06 41.28 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.945 0.878 . . . . 0.0 112.783 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.0 m -112.54 100.94 9.13 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 112.585 -2.098 . . . . 0.0 108.341 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 10.5 mptt 58.48 7.99 0.79 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.156 0.91 . . . . 0.0 112.873 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.6 p -141.19 107.78 5.33 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 123.438 0.461 . . . . 0.0 110.055 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.508 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 41.5 t -157.31 140.98 15.86 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-N 115.077 -0.965 . . . . 0.0 108.476 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -81.25 -53.13 6.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.5 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.429 ' N ' HD21 ' A' ' 14' ' ' ASN . 0.0 OUTLIER -178.45 77.47 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.2 m -68.4 145.39 54.17 Favored 'General case' 0 N--CA 1.5 2.07 0 C-N-CA 119.061 -1.056 . . . . 0.0 111.014 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.438 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.1 m -47.94 -28.57 2.78 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.995 1.434 . . . . 0.0 109.075 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.7 mmm-85 -116.47 -110.86 0.35 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 106.163 -1.792 . . . . 0.0 106.163 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.6 p -173.72 140.63 0.78 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 58.9 m -51.63 103.52 0.06 Allowed 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 . . . . . 0 N--CA 1.495 1.801 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 179.752 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 N--CA 1.499 2.014 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -132.31 2.74 3.9 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.001 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 pttm 40.95 33.4 0.21 Allowed 'General case' 0 N--CA 1.506 2.373 0 O-C-N 124.978 1.424 . . . . 0.0 109.632 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -138.36 139.7 39.12 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 111.284 -2.689 . . . . 0.0 108.969 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 67.1 m -65.42 144.17 57.24 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.737 1.256 . . . . 0.0 113.815 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 . . . . . 0 N--CA 1.492 1.628 0 CA-C-N 111.94 -2.391 . . . . 0.0 111.701 179.955 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.408 ' SG ' ' N ' ' A' ' 16' ' ' CYS . 69.2 m . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.498 ' HG3' ' H ' ' A' ' 3' ' ' SER . 52.7 tptt -107.51 -134.53 0.34 Allowed 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.498 ' H ' ' HG3' ' A' ' 2' ' ' LYS . 80.9 p . . . . . 0 N--CA 1.496 1.848 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.988 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.576 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 29.5 m -64.68 142.0 58.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.4 p -54.92 83.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 125.514 1.759 . . . . 0.0 115.624 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.465 ' SG ' ' OG ' ' A' ' 12' ' ' SER . 40.5 t -143.57 132.7 23.04 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.146 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 41.2 t -79.97 -71.96 0.43 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 114.075 -1.421 . . . . 0.0 113.457 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.426 ' NZ ' ' HB2' ' A' ' 10' ' ' LYS . 4.8 ttmp? -118.91 -46.3 2.54 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.7 t -151.01 125.12 9.3 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.465 ' OG ' ' SG ' ' A' ' 8' ' ' CYS . 72.1 m -138.99 -8.78 1.35 Allowed 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 112.903 -1.953 . . . . 0.0 108.823 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 60.74 5.93 1.04 Allowed 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 114.479 1.289 . . . . 0.0 114.479 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -82.11 -77.83 0.22 Allowed 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.11 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 71.3 m -44.34 130.11 6.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.408 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 90.3 m -66.12 -15.58 63.23 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.413 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 2.9 mmp_? -90.01 -110.94 0.08 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 61.5 p -161.19 171.53 18.3 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.1 m -100.18 122.29 42.79 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -179.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.471 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.908 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.0 p90 . . . . . 0 N--CA 1.502 2.168 0 CA-C-O 122.678 1.228 . . . . 0.0 111.425 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.405 ' H ' ' H ' ' A' ' 24' ' ' LYS . 81.2 p -148.7 -9.56 0.35 Allowed 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 112.26 -2.245 . . . . 0.0 105.696 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.405 ' H ' ' H ' ' A' ' 23' ' ' THR . 0.0 OUTLIER 40.46 32.51 0.14 Allowed 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 123.398 1.57 . . . . 0.0 112.137 -179.703 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -132.64 164.97 25.53 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 110.282 -3.145 . . . . 0.0 106.663 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.0 m -85.95 161.5 18.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.349 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 N--CA 1.49 1.534 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.823 179.646 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -87.67 162.79 16.9 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.5 p . . . . . 0 N--CA 1.495 1.82 0 O-C-N 124.007 0.817 . . . . 0.0 112.928 -179.872 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.949 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.522 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 38.5 m -44.6 135.18 5.0 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.8 p -64.22 90.43 0.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 124.579 1.174 . . . . 0.0 113.203 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.7 p -100.69 -155.12 0.5 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.445 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.8 p -154.02 -50.92 0.09 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.037 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -167.37 -35.26 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 124.018 0.824 . . . . 0.0 109.843 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.3 m -115.17 94.14 4.6 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.146 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.8 t -158.65 61.88 0.43 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.036 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -66.6 -15.05 63.16 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.987 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -58.3 -31.49 67.55 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 124.206 0.942 . . . . 0.0 111.568 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.522 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 67.5 m -62.07 130.21 44.46 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.479 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.8 m -39.79 -43.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 125.246 1.591 . . . . 0.0 113.022 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -98.21 -82.69 0.42 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 123.987 0.804 . . . . 0.0 109.32 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.2 p -172.1 168.38 5.82 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 123.485 0.49 . . . . 0.0 110.866 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -91.25 135.76 33.57 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 . . . . . 0 N--CA 1.498 1.94 0 O-C-N 124.902 1.376 . . . . 0.0 108.903 179.798 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.5 p -115.65 -1.93 12.59 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.588 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm 54.07 28.92 9.44 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.48 168.35 19.64 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 104.691 -2.337 . . . . 0.0 104.691 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.2 m -93.03 150.23 20.67 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.478 -0.889 . . . . 0.0 113.019 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 . . . . . 0 N--CA 1.488 1.443 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.51 179.873 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.467 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 9.8 p . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -89.6 172.91 8.62 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-N 114.389 -1.278 . . . . 0.0 109.908 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 82.6 p . . . . . 0 N--CA 1.497 1.897 0 CA-C-N 114.669 -1.15 . . . . 0.0 112.394 179.865 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.402 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.479 1.506 0 CA-C-O 118.358 -1.246 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -57.17 135.81 56.41 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 118.399 1.1 . . . . 0.0 108.123 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 42.4 t -70.87 84.85 0.67 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 124.611 1.194 . . . . 0.0 110.564 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 8.3 p -115.29 142.09 47.14 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -93.69 -172.05 2.77 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 111.988 -2.369 . . . . 0.0 110.169 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -63.56 -19.86 65.16 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -89.82 17.62 6.47 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 123.397 0.436 . . . . 0.0 110.817 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.451 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 45.0 t -158.62 134.23 8.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.696 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.474 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 69.5 m-85 -145.09 27.25 1.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 CA-C-N 113.816 -1.538 . . . . 0.0 107.087 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -54.23 -28.13 39.25 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-N 114.048 -1.433 . . . . 0.0 114.393 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -65.59 155.69 35.02 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.467 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 36.2 m -52.85 -39.85 62.89 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 112.374 -2.194 . . . . 0.0 111.417 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.432 ' N ' ' HD2' ' A' ' 17' ' ' ARG . 2.2 mpt_? -92.54 -89.01 0.2 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.1 p -173.62 -172.99 0.82 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 13' ' ' TYR . 73.9 m -108.72 104.27 13.53 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.495 1.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 109.304 179.674 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 . . . . . 0 N--CA 1.498 1.97 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.2 p -91.84 -7.72 48.58 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.686 -1.597 . . . . 0.0 108.731 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.409 ' NZ ' ' HB3' ' A' ' 24' ' ' LYS . 6.8 mtpm? 54.26 27.05 7.4 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -133.96 167.63 20.26 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 111.888 -2.415 . . . . 0.0 110.073 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 93.7 m -82.9 154.32 24.65 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.494 1.14 . . . . 0.0 113.852 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 . . . . . 0 C--N 1.303 -1.455 0 CA-C-N 112.513 -2.13 . . . . 0.0 108.736 179.756 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -99.43 163.12 12.65 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.108 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 N--CA 1.496 1.848 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.771 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.862 0 CA-C-O 119.251 -0.749 . . . . 0.0 111.66 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.6 t -66.18 152.41 44.88 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -67.28 88.21 0.18 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 124.285 0.99 . . . . 0.0 111.499 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -93.4 148.65 21.87 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.42 -1.264 . . . . 0.0 111.132 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.6 t -83.09 169.61 15.69 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -53.14 -51.78 60.83 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.602 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.4 t -97.93 59.12 1.41 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.365 1.041 . . . . 0.0 112.883 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.7 p -159.4 85.01 0.78 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.194 0.997 . . . . 0.0 109.647 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -94.38 52.3 1.55 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.227 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.422 ' H ' HD21 ' A' ' 14' ' ' ASN . 3.9 m-80 -64.54 -35.86 82.32 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.065 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 77.1 m -66.08 146.68 54.39 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 124.13 0.894 . . . . 0.0 110.644 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.3 m -58.17 -18.45 25.78 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 123.738 0.649 . . . . 0.0 111.284 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.0 mmm-85 -89.46 -95.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.8 p -174.13 -172.49 0.71 Allowed 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.9 t -119.86 120.83 37.61 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 . . . . . 0 N--CA 1.493 1.72 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 179.875 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 . . . . . 0 N--CA 1.501 2.108 0 N-CA-C 104.337 -2.468 . . . . 0.0 104.337 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.7 t -89.71 -4.86 57.52 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 112.771 -2.013 . . . . 0.0 107.812 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm 51.18 29.81 5.14 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 122.46 1.124 . . . . 0.0 108.733 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -135.59 157.41 46.95 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 111.839 -2.437 . . . . 0.0 110.025 -179.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.4 m -74.66 163.97 27.11 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.83 0.824 . . . . 0.0 112.369 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 . . . . . 0 N--CA 1.488 1.445 0 CA-C-N 113.708 -1.587 . . . . 0.0 109.82 179.765 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.6 p . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -134.5 -177.11 4.46 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.436 ' C ' ' H ' ' A' ' 5' ' ' GLY . 50.0 m -63.77 159.65 18.94 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.604 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.436 ' H ' ' C ' ' A' ' 3' ' ' SER . . . -178.9 10.61 0.03 OUTLIER Glycine 0 N--CA 1.485 1.918 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.225 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 t -64.96 138.16 58.19 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.5 m -65.32 91.14 0.11 Allowed 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.381 1.05 . . . . 0.0 113.015 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -89.6 -152.69 0.25 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.203 -1.362 . . . . 0.0 107.542 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.439 ' HG ' ' H ' ' A' ' 10' ' ' LYS . 35.8 t -162.16 -120.0 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.439 ' H ' ' HG ' ' A' ' 9' ' ' SER . 0.3 OUTLIER -110.32 -42.23 4.19 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.8 p -89.76 -21.13 22.8 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.273 0.983 . . . . 0.0 111.706 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -72.56 94.96 1.76 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 123.741 0.651 . . . . 0.0 110.583 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -103.42 21.84 15.28 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.654 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -77.94 21.11 0.33 Allowed 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.325 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.8 m -96.15 125.82 40.94 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -63.05 -29.54 70.9 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 119.532 1.06 . . . . 0.0 108.213 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.6 tpt85 -89.35 -85.53 0.2 Allowed 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.1 p -174.66 167.62 3.77 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.836 0.71 . . . . 0.0 109.489 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.2 t -102.42 117.38 34.61 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.403 1.261 . . . . 0.0 114.403 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.446 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 46.2 t30 -89.6 111.22 22.1 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 124.433 1.083 . . . . 0.0 108.621 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -89.44 -34.59 16.4 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.4 p -108.87 -4.1 17.1 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 113.668 -1.605 . . . . 0.0 109.872 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 53.78 26.2 5.81 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -132.89 161.04 35.27 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 112.506 -2.133 . . . . 0.0 109.893 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.8 m -75.35 141.92 43.25 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 123.659 0.6 . . . . 0.0 112.147 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 80.9 m-85 -59.45 149.58 29.09 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.983 0.897 . . . . 0.0 109.749 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.462 0 O-C-N 119.49 -2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 24.4 p . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 121.223 0.535 . . . . 0.0 111.461 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.447 ' NZ ' ' HB3' ' A' ' 2' ' ' LYS . 3.3 mmmp? -107.56 -177.43 3.35 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.624 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.2 p -60.28 161.05 7.6 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 123.448 0.468 . . . . 0.0 111.245 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.466 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 179.73 8.67 0.02 OUTLIER Glycine 0 N--CA 1.479 1.516 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.627 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.472 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 69.9 m -67.96 136.57 54.14 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 120.925 0.393 . . . . 0.0 111.656 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.2 m -57.25 93.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.4 p -142.75 127.8 18.5 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.443 ' HG ' ' N ' ' A' ' 10' ' ' LYS . 32.4 t -59.85 171.75 0.87 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.381 -179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.443 ' N ' ' HG ' ' A' ' 9' ' ' SER . 5.6 tmtt? -41.22 -66.16 0.36 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-N 114.063 -1.426 . . . . 0.0 108.595 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 68.5 p -90.04 65.79 6.62 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.084 0.865 . . . . 0.0 111.791 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 m -143.19 25.92 1.69 Allowed 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 114.542 -1.208 . . . . 0.0 107.803 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.435 ' HH ' ' HD3' ' A' ' 10' ' ' LYS . 62.4 m-85 -55.62 94.59 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.619 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -147.26 0.17 0.7 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.815 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 45.5 m -72.6 168.07 19.39 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.982 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.7 m -64.2 -29.62 70.72 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -108.65 -83.75 0.55 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 113.39 -1.732 . . . . 0.0 106.931 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.469 ' OG ' ' CD1' ' A' ' 27' ' ' TYR . 33.1 p -175.63 -175.18 0.75 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 123.965 0.79 . . . . 0.0 108.915 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.484 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 98.8 m -106.97 100.52 10.01 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -48.61 111.33 0.45 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 112.249 -2.251 . . . . 0.0 108.934 179.698 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -89.11 12.71 14.95 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 124.352 1.033 . . . . 0.0 112.356 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 31.3 m -144.05 -7.62 0.72 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt 47.66 36.8 5.92 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.271 0.982 . . . . 0.0 108.931 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.501 ' HG3' ' N ' ' A' ' 26' ' ' CYS . 10.2 ptt-85 -128.79 -174.68 3.32 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.705 -2.702 . . . . 0.0 103.705 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.501 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 97.3 m -91.32 140.72 29.51 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 118.941 0.791 . . . . 0.0 109.211 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.469 ' CD1' ' OG ' ' A' ' 18' ' ' SER . 19.6 m-85 -50.58 134.43 24.25 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 121.63 0.729 . . . . 0.0 110.299 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.44 0 O-C-N 119.17 -2.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.461 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 29.3 p . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.461 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 34.8 mmtp -143.32 175.45 9.89 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.8 p -65.53 153.6 41.02 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.454 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 155.03 5.68 0.09 OUTLIER Glycine 0 N--CA 1.483 1.786 0 CA-C-N 113.715 -1.584 . . . . 0.0 111.604 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.481 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 32.9 t -65.35 145.28 56.38 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.2 p -72.31 103.55 3.44 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.584 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 18.7 t -122.74 147.88 45.98 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.184 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.9 m -98.21 -76.29 0.53 Allowed 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.319 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -143.4 -54.66 0.38 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 124.222 0.951 . . . . 0.0 111.037 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -89.43 -5.31 57.5 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.584 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 59.2 m -75.64 87.48 2.72 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -72.1 18.84 0.08 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 114.36 -1.291 . . . . 0.0 113.15 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.439 ' H ' ' C ' ' A' ' 12' ' ' SER . 9.1 m-80 -69.43 -2.64 11.6 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.064 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.8 m -96.83 115.88 28.2 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 22.3 m -69.48 -23.92 63.71 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.559 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -89.24 -83.69 0.23 Allowed 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.1 p -175.37 168.14 3.3 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.896 0.747 . . . . 0.0 109.942 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 73.1 m -95.81 116.4 28.85 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.436 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -94.99 111.17 22.99 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . 0.473 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -89.57 23.96 2.45 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-O 122.25 1.024 . . . . 0.0 110.639 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 21' ' ' HYP . 54.6 m -150.11 -20.96 0.25 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.929 -1.941 . . . . 0.0 106.989 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 49.75 41.51 22.23 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 124.363 1.039 . . . . 0.0 108.497 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -147.59 163.41 36.69 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.481 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 62.1 m -84.83 144.65 28.3 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.46 -0.896 . . . . 0.0 109.346 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -58.89 150.09 25.16 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.928 0.87 . . . . 0.0 110.869 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.421 0 O-C-N 119.586 -1.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.8 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 110.629 -0.137 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.476 ' HD3' ' H ' ' A' ' 3' ' ' SER . 1.8 tmtm? -104.48 146.34 29.01 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.476 ' H ' ' HD3' ' A' ' 2' ' ' LYS . 49.2 m -44.49 144.37 1.08 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 123.674 0.608 . . . . 0.0 111.606 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.87 21.67 0.02 OUTLIER Glycine 0 N--CA 1.486 2.025 0 CA-C-N 113.933 -1.485 . . . . 0.0 110.94 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.426 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 49.6 m -81.93 152.28 26.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 54.9 m -63.85 98.48 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.508 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 42.5 t -89.45 103.89 16.49 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.2 m -80.86 -152.32 0.09 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.487 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -22.2 50.35 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.903 179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.4 p -97.71 149.24 22.51 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 m -136.3 9.19 3.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 123.665 0.603 . . . . 0.0 110.807 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -62.37 -17.55 59.29 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.179 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -65.76 -55.72 15.78 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.144 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 75.4 m -95.36 140.42 30.26 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.081 0.863 . . . . 0.0 112.405 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.1 m -66.98 -11.73 57.68 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -89.59 -121.99 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 p -164.49 -174.89 3.63 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.9 m -81.33 109.5 15.89 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 117.705 2.483 . . . . 0.0 117.705 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.479 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -90.54 106.48 18.53 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 179.382 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . 0.422 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -88.91 25.14 1.86 Allowed 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 122.206 1.003 . . . . 0.0 111.892 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.422 ' H ' ' C ' ' A' ' 21' ' ' HYP . 70.4 p -150.14 -17.33 0.25 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.036 -1.893 . . . . 0.0 107.919 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.9 mttp 56.44 33.19 22.04 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -140.74 178.67 7.18 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.548 -2.569 . . . . 0.0 108.581 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 74.1 m -85.49 167.17 15.7 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -74.93 85.03 2.24 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 122.33 1.062 . . . . 0.0 110.863 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.424 0 O-C-N 119.581 -1.95 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.573 0.701 . . . . 0.0 112.111 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -100.95 153.89 19.14 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.789 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.3 t -57.24 146.57 27.96 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 124.07 0.856 . . . . 0.0 109.921 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.476 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 84.75 8.18 83.12 Favored Glycine 0 N--CA 1.486 1.99 0 O-C-N 125.02 1.45 . . . . 0.0 111.695 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.485 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 34.2 t -70.18 133.38 47.03 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.2 t -68.8 109.1 3.7 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 20.9 p -148.9 149.3 31.02 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 114.761 -1.109 . . . . 0.0 113.267 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 80.3 p -62.48 176.01 0.7 Allowed 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 113.553 -1.658 . . . . 0.0 113.793 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.99 -36.49 49.94 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.1 p -88.62 -139.31 0.12 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 46.3 t 49.97 73.59 0.25 Allowed 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.521 0.677 . . . . 0.0 109.37 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -81.88 40.51 0.61 Allowed 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.422 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -91.59 7.75 39.97 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.995 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 69.6 m -90.87 134.92 34.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 123.571 0.544 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 64.2 m -57.62 -28.19 63.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 -103.82 -85.53 0.46 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 36.3 p 179.28 166.32 1.02 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.659 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 79.5 m -91.68 113.62 25.94 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.49 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -88.2 123.92 33.31 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.547 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . 0.418 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -88.91 23.92 2.22 Favored 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 122.44 1.114 . . . . 0.0 112.537 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.418 ' H ' ' C ' ' A' ' 21' ' ' HYP . 8.4 t -150.72 -16.33 0.23 Allowed 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 113.002 -1.908 . . . . 0.0 107.671 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt 50.31 44.53 26.5 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 122.727 1.251 . . . . 0.0 107.701 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 92.0 mtt-85 -150.14 158.1 43.81 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 110.963 -2.835 . . . . 0.0 108.559 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.485 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 74.1 m -76.3 138.03 40.26 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.751 -0.779 . . . . 0.0 110.434 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.436 ' CE1' ' HA ' ' A' ' 20' ' ' ASN . 84.1 m-85 -46.15 141.65 3.22 Favored 'General case' 0 N--CA 1.497 1.875 0 CA-C-O 121.927 0.87 . . . . 0.0 112.101 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.384 0 O-C-N 119.532 -1.98 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.456 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 21.3 p . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -89.79 164.91 14.46 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 77.9 p -51.9 147.93 6.45 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.321 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.407 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 139.69 7.35 1.03 Allowed Glycine 0 N--CA 1.486 1.994 0 O-C-N 125.321 1.638 . . . . 0.0 111.755 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.622 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 23.4 m -63.46 140.85 58.91 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-N 117.818 0.809 . . . . 0.0 109.49 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.6 m -59.94 95.07 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.482 1.114 . . . . 0.0 113.544 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.441 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 42.9 t -150.38 154.47 37.83 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.003 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.0 m -145.01 54.85 1.22 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.054 -1.43 . . . . 0.0 108.83 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.506 ' H ' ' CB ' ' A' ' 19' ' ' CYS . 32.3 mmmt 68.94 42.36 1.32 Allowed 'General case' 0 N--CA 1.504 2.237 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.413 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 66.1 p -140.42 26.71 2.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 113.444 -1.707 . . . . 0.0 110.752 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.441 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 42.9 t -152.8 -52.53 0.11 Allowed 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 57.58 12.44 1.55 Allowed 'General case' 0 N--CA 1.503 2.183 0 O-C-N 124.505 1.128 . . . . 0.0 111.768 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -75.82 -42.12 50.72 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.323 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.622 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 87.6 m -49.29 144.55 5.23 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 115.999 1.851 . . . . 0.0 115.999 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.456 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 35.0 m -54.63 -42.79 71.66 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 112.44 -2.164 . . . . 0.0 110.861 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.409 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -89.79 -91.72 0.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.3 p -171.81 179.29 2.8 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.506 ' CB ' ' H ' ' A' ' 10' ' ' LYS . 80.1 m -96.09 115.75 27.91 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -92.46 109.05 20.43 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.408 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -88.77 -18.8 26.99 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-O 122.129 0.966 . . . . 0.0 108.671 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.424 ' HG1' ' H ' ' A' ' 25' ' ' ARG . 41.6 p -119.6 -9.01 9.88 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 112.873 -1.967 . . . . 0.0 107.624 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt 51.45 26.57 3.25 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.81 1.319 . . . . 0.0 108.321 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.424 ' H ' ' HG1' ' A' ' 23' ' ' THR . 8.1 ptm180 -133.54 177.99 7.27 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 103.864 -2.643 . . . . 0.0 103.864 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.407 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 89.2 m -95.39 153.46 17.68 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -65.12 152.76 42.75 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.759 0.79 . . . . 0.0 109.467 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.416 0 O-C-N 119.594 -1.941 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 23.1 p . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 121.184 0.516 . . . . 0.0 111.746 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -116.3 168.23 10.32 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.732 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.4 p -56.15 161.53 2.38 Favored 'General case' 0 N--CA 1.497 1.906 0 CA-C-N 114.448 -1.251 . . . . 0.0 112.31 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.88 4.37 85.55 Favored Glycine 0 N--CA 1.485 1.965 0 O-C-N 124.884 1.365 . . . . 0.0 112.145 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.5 t -69.02 152.82 44.77 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.3 m -74.29 104.42 5.05 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 117.866 2.543 . . . . 0.0 117.866 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.626 ' SG ' ' N ' ' A' ' 12' ' ' SER . 2.2 t -88.9 137.94 31.86 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.6 t -77.74 78.53 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.9 tttp 63.53 -70.14 0.07 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 113.046 -1.888 . . . . 0.0 110.656 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.1 p -125.32 27.9 6.46 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 123.327 0.392 . . . . 0.0 111.923 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.626 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 90.2 p -68.45 107.17 2.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -74.47 82.54 1.96 Allowed 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.9 p30 -147.09 5.57 0.85 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 112.754 -2.021 . . . . 0.0 109.882 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 72.9 m -95.35 128.25 42.05 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.292 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 67.5 m -55.09 -30.66 60.14 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.5 mmm-85 -90.58 -94.08 0.12 Allowed 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 104.821 -2.289 . . . . 0.0 104.821 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 p -177.83 176.09 1.24 Allowed 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.484 ' SG ' ' O ' ' A' ' 12' ' ' SER . 75.3 m -90.66 106.32 18.42 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 116.16 1.911 . . . . 0.0 116.16 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.409 HD21 ' H ' ' A' ' 23' ' ' THR . 0.4 OUTLIER -84.29 109.08 17.53 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.341 -1.725 . . . . 0.0 106.341 179.597 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -88.92 -24.29 22.5 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.409 ' H ' HD21 ' A' ' 20' ' ' ASN . 41.4 p -121.25 5.72 10.24 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 112.872 -1.967 . . . . 0.0 109.122 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.13 30.93 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.472 0 O-C-N 125.34 1.65 . . . . 0.0 113.117 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.403 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 15.2 ptm180 -127.32 -168.02 1.82 Allowed 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 112.042 -2.345 . . . . 0.0 105.539 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.5 m -95.34 152.39 18.42 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.614 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -65.6 167.38 9.09 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 122.195 0.998 . . . . 0.0 111.236 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.424 0 O-C-N 119.838 -1.789 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.172 0.51 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -84.93 160.25 20.15 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.955 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.0 m -58.34 146.95 32.72 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.437 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 147.04 19.95 0.11 Allowed Glycine 0 N--CA 1.484 1.869 0 CA-C-N 113.645 -1.616 . . . . 0.0 110.982 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.3 m -78.76 135.93 37.25 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.9 t -55.18 91.79 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 124.532 1.145 . . . . 0.0 113.609 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.448 ' H ' ' HA ' ' A' ' 25' ' ' ARG . 28.4 p -92.1 -169.46 2.26 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.092 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.0 m -143.22 -50.71 0.34 Allowed 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.019 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.424 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 5.6 ttpm? -167.55 -47.76 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.968 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 t -89.61 68.04 7.6 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.149 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -88.77 39.46 0.92 Allowed 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 114.496 -1.229 . . . . 0.0 113.743 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -62.06 -24.09 66.88 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -57.82 -43.4 85.71 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 114.259 -1.337 . . . . 0.0 108.858 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.5 m -83.75 138.12 33.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 124.526 1.141 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.21 -22.14 65.69 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 123.776 0.672 . . . . 0.0 110.883 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -89.44 -111.81 0.07 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 124.075 0.859 . . . . 0.0 108.814 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.9 p -163.79 -156.35 0.35 Allowed 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 117.751 -1.118 . . . . 0.0 109.173 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.5 t -117.19 109.89 17.47 Favored 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -82.42 113.53 20.24 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 114.902 -1.044 . . . . 0.0 108.241 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -88.93 -4.27 58.5 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 124.397 1.061 . . . . 0.0 109.008 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.4 p -139.1 -9.29 1.31 Allowed 'General case' 0 N--CA 1.492 1.636 0 CA-C-N 113.016 -1.902 . . . . 0.0 108.896 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.417 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 7.0 mtpm? 49.34 29.21 2.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.771 1.294 . . . . 0.0 108.469 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HA ' ' H ' ' A' ' 8' ' ' CYS . 5.6 ptp180 -130.33 170.22 14.43 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -77.0 152.83 35.03 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -67.68 154.24 41.91 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.767 -0.773 . . . . 0.0 109.312 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.415 0 O-C-N 119.797 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.531 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 2.5 mppt? -92.32 157.55 16.58 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.417 ' N ' ' HG ' ' A' ' 6' ' ' SER . 54.0 m -57.65 150.97 18.19 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 123.23 0.331 . . . . 0.0 111.433 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 142.89 7.93 0.59 Allowed Glycine 0 N--CA 1.485 1.928 0 CA-C-N 112.982 -1.917 . . . . 0.0 108.706 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.417 ' HG ' ' N ' ' A' ' 3' ' ' SER . 70.1 m -65.99 143.35 57.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.8 t -50.64 96.41 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 O-C-N 125.355 1.66 . . . . 0.0 114.455 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.517 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 47.9 t -140.71 149.42 42.17 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.588 0.709 . . . . 0.0 111.494 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.1 m -151.8 -65.03 0.18 Allowed 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.412 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 3.8 mmmp? -148.43 19.75 1.06 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 124.847 1.342 . . . . 0.0 109.061 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -114.87 -63.18 1.49 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 123.648 0.593 . . . . 0.0 111.635 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.517 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 49.3 m -62.95 143.56 57.61 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 123.915 0.759 . . . . 0.0 109.161 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -67.42 21.98 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.8 m120 68.17 115.51 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.35 1.071 . . . . 0.0 113.887 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 2' ' ' LYS . 72.2 m -57.54 170.49 0.54 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.312 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 99.0 m -53.22 -20.89 4.5 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.587 -0.445 . . . . 0.0 112.026 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -89.52 -76.22 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.407 ' OG ' ' CD2' ' A' ' 27' ' ' TYR . 30.6 p 175.19 178.4 0.15 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 124.641 1.213 . . . . 0.0 109.612 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -104.91 120.56 41.73 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.495 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -99.93 109.11 21.48 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 123.957 0.786 . . . . 0.0 109.74 179.997 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -89.13 18.29 5.14 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 124.027 0.829 . . . . 0.0 112.23 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.3 m -136.16 -11.58 1.94 Allowed 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 106.252 -1.759 . . . . 0.0 106.252 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm 53.29 31.86 12.53 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.413 ' HA ' ' H ' ' A' ' 8' ' ' CYS . 81.4 mtt85 -148.84 178.05 9.0 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.808 -1.996 . . . . 0.0 110.478 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.0 m -95.94 -178.49 4.37 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.407 ' CD2' ' OG ' ' A' ' 18' ' ' SER . 73.3 m-85 -95.13 171.55 8.67 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.548 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.506 0 O-C-N 119.917 -1.739 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.424 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 17.1 p . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 121.276 0.56 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -94.9 165.41 12.47 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.602 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -62.75 155.95 25.15 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.542 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.47 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 70.43 8.93 63.65 Favored Glycine 0 N--CA 1.488 2.14 0 O-C-N 125.168 1.542 . . . . 0.0 113.564 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 32.0 t -64.94 133.29 51.46 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.7 p -63.84 84.51 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 23.0 p -126.83 123.95 38.51 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.367 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.5 p -34.44 -101.53 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 118.423 2.749 . . . . 0.0 118.423 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -148.07 -34.42 0.23 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 118.396 0.544 . . . . 0.0 111.827 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -89.58 -10.33 46.47 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.47 1.106 . . . . 0.0 110.463 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.1 m -59.21 -65.26 0.7 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.538 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.426 ' N ' ' SG ' ' A' ' 19' ' ' CYS . 36.3 m-85 55.2 19.39 2.87 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 124.064 0.852 . . . . 0.0 110.182 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -58.87 -34.88 72.12 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 92.0 m -69.23 151.01 46.81 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.424 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 46.9 m -44.17 -39.55 4.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 125.557 1.786 . . . . 0.0 108.686 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -89.81 -94.15 0.11 Allowed 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 105.569 -2.012 . . . . 0.0 105.569 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.7 p -171.26 176.36 3.93 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 119.391 0.996 . . . . 0.0 112.691 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.426 ' SG ' ' N ' ' A' ' 13' ' ' TYR . 80.5 m -106.22 112.15 25.06 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 123.939 0.775 . . . . 0.0 113.066 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.44 HD21 ' CG2' ' A' ' 23' ' ' THR . 60.6 t30 -83.96 131.09 34.87 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.095 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . 0.442 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -89.04 21.25 3.22 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 123.035 1.398 . . . . 0.0 112.918 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.442 ' H ' ' C ' ' A' ' 21' ' ' HYP . 7.8 t -150.9 -13.04 0.22 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 111.653 -2.522 . . . . 0.0 106.471 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? 38.79 41.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 125.241 1.588 . . . . 0.0 110.958 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HG2' ' CG2' ' A' ' 23' ' ' THR . 9.2 ptm180 -139.2 164.22 30.38 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 102.978 -2.971 . . . . 0.0 102.978 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 89.4 m -75.7 165.4 25.11 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 118.51 -1.276 . . . . 0.0 113.183 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -76.23 166.34 23.6 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.181 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.456 0 O-C-N 119.864 -1.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.0 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.475 0.655 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 11.8 mptt -89.18 179.85 6.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.967 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.6 p -63.33 154.87 30.42 Favored 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.633 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.79 18.92 0.04 OUTLIER Glycine 0 N--CA 1.482 1.701 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.416 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 67.5 m -64.12 133.3 52.72 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.6 p -58.31 89.04 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 O-C-N 124.947 1.404 . . . . 0.0 114.309 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 38.1 t -89.38 145.74 25.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.828 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.1 p -100.45 46.86 0.94 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp 65.56 -2.37 0.85 Allowed 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.945 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.8 p -143.32 80.46 1.67 Allowed 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.651 0.738 . . . . 0.0 110.805 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.488 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 39.4 t -159.54 82.91 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -76.17 5.17 7.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 114.044 -1.435 . . . . 0.0 110.67 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.422 ' H ' HD21 ' A' ' 14' ' ' ASN . 6.6 m-80 -55.3 -39.52 70.0 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.372 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.416 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 76.2 m -71.14 150.79 45.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.788 0.68 . . . . 0.0 109.904 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 94.3 m -58.56 -35.98 73.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 123.684 0.615 . . . . 0.0 112.142 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -89.73 -101.68 0.1 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 117.808 -1.091 . . . . 0.0 111.523 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.9 p -166.37 -171.73 2.01 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 119.636 1.107 . . . . 0.0 112.152 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 88.7 m -96.39 114.43 26.1 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.459 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -92.21 110.48 21.87 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . 0.406 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -89.4 16.11 8.08 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 122.35 1.071 . . . . 0.0 110.945 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.406 ' H ' ' C ' ' A' ' 21' ' ' HYP . 59.1 m -143.71 -7.81 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HZ3' HH12 ' A' ' 25' ' ' ARG . 24.1 pttm 37.71 34.32 0.05 Allowed 'General case' 0 N--CA 1.507 2.396 0 CA-C-O 122.811 1.291 . . . . 0.0 111.563 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.436 HH12 ' HZ3' ' A' ' 24' ' ' LYS . 81.2 mtt85 -142.31 170.86 14.91 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 111.391 -2.64 . . . . 0.0 108.694 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.5 m -84.89 157.76 20.79 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.36 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -73.1 157.91 36.36 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.58 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.421 0 O-C-N 119.854 -1.779 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.7 p . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.397 0.618 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -84.53 177.64 8.02 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.57 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m -53.88 136.07 41.21 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 115.032 -0.985 . . . . 0.0 113.079 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 97.64 -7.67 63.49 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.4 t -56.67 144.51 32.03 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.4 m -66.12 86.09 0.1 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.461 ' SG ' ' OG ' ' A' ' 12' ' ' SER . 37.3 t -89.85 120.14 30.83 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.668 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.7 t -124.02 63.18 1.07 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt 79.66 -49.03 0.38 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-N 112.939 -1.937 . . . . 0.0 109.925 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 70.0 p -89.59 107.97 19.39 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 123.848 0.718 . . . . 0.0 110.992 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.461 ' OG ' ' SG ' ' A' ' 8' ' ' CYS . 89.6 p -169.19 3.94 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.605 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 56.35 22.0 5.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 123.685 0.616 . . . . 0.0 111.083 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 42.6 t30 63.01 106.21 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.153 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.3 m -59.5 166.17 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.959 -1.473 . . . . 0.0 109.52 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.0 m -36.19 -43.63 0.36 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 124.234 0.959 . . . . 0.0 112.362 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.5 mtt-85 -101.83 -96.78 0.28 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 107.543 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -168.7 147.28 4.13 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 75.7 m -66.8 143.64 56.78 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.916 -1.947 . . . . 0.0 113.506 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -131.95 104.6 6.93 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -88.58 -47.86 7.99 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 103.995 -2.594 . . . . 0.0 103.995 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.7 p -90.01 -10.18 45.86 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.445 -1.707 . . . . 0.0 107.52 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 51.97 33.58 12.05 Favored 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -141.11 152.01 44.41 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 110.742 -2.935 . . . . 0.0 109.464 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.6 m -83.47 -178.27 7.0 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.615 0.722 . . . . 0.0 110.108 179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -95.64 153.06 17.91 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 114.087 -1.415 . . . . 0.0 107.606 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.362 0 O-C-N 119.912 -1.743 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.45 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 14.2 p . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 121.02 0.438 . . . . 0.0 112.176 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.404 ' HB2' ' NZ ' ' A' ' 2' ' ' LYS . 10.1 mtmp? -83.69 -179.08 7.22 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.188 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.7 p -58.99 151.35 22.24 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 115.019 -0.991 . . . . 0.0 112.28 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 174.84 8.78 0.02 OUTLIER Glycine 0 N--CA 1.486 2.002 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.44 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.464 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 61.3 m -64.08 134.04 54.17 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 51.6 m -60.6 90.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 124.696 1.247 . . . . 0.0 114.161 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 28.3 p -149.33 168.28 23.8 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.246 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -169.77 164.02 9.89 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 113.909 -1.496 . . . . 0.0 110.531 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp 48.99 -99.65 0.06 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -89.34 78.72 7.17 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.98 0.895 . . . . 0.0 109.649 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.408 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 59.4 m -155.05 116.11 3.97 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -135.45 84.56 2.1 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -140.1 -48.75 0.45 Allowed 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.779 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 92.9 m -57.51 141.66 46.96 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.45 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.3 m -46.46 -33.7 4.19 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 113.006 -1.906 . . . . 0.0 110.634 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -99.26 -93.34 0.26 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.0 p -174.59 -178.19 1.3 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 76.7 m -98.8 109.28 22.06 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.513 HD21 ' H ' ' A' ' 23' ' ' THR . 6.6 t30 -79.86 109.49 14.33 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.613 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.412 ' HB2' HD22 ' A' ' 20' ' ' ASN . 72.3 m-85 -88.79 -41.05 12.75 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.513 ' H ' HD21 ' A' ' 20' ' ' ASN . 74.7 p -90.99 -9.72 44.96 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.835 -1.53 . . . . 0.0 107.556 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 54.69 28.45 10.11 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -139.05 166.52 24.28 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 111.253 -2.703 . . . . 0.0 108.501 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 90.4 m -79.23 154.76 28.96 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -61.77 98.62 0.1 Allowed 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 113.442 -1.708 . . . . 0.0 110.566 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.394 0 O-C-N 119.614 -1.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.569 0.699 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.08 147.44 23.72 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 113.655 -1.611 . . . . 0.0 107.775 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 57.5 m -53.07 157.16 1.87 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.293 0.996 . . . . 0.0 112.359 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 76.87 9.0 86.77 Favored Glycine 0 N--CA 1.489 2.218 0 O-C-N 124.759 1.287 . . . . 0.0 112.249 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.459 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 33.1 t -65.06 140.13 58.8 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.2 m -63.59 91.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -106.71 126.24 52.03 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.41 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.5 m -140.71 84.86 1.96 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 124.158 0.911 . . . . 0.0 110.932 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? 52.8 25.94 4.2 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.411 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -145.66 -43.49 0.21 Allowed 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 m -85.0 57.55 4.51 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -80.38 80.64 6.79 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.478 1.133 . . . . 0.0 108.207 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 p30 -162.3 15.34 0.08 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.889 -1.959 . . . . 0.0 109.87 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 81.9 m -65.23 126.31 27.77 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.1 m -45.0 -39.69 5.81 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -94.66 -83.33 0.35 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.7 p -176.62 170.62 2.41 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.813 0.696 . . . . 0.0 110.838 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 87.3 m -94.24 112.67 24.49 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.503 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -87.86 116.38 25.98 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 114.539 -1.209 . . . . 0.0 107.797 179.751 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . 0.467 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -88.83 25.13 1.85 Allowed 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 122.704 1.24 . . . . 0.0 111.423 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.467 ' H ' ' C ' ' A' ' 21' ' ' HYP . 65.0 p -150.11 -15.54 0.25 Allowed 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 112.368 -2.197 . . . . 0.0 107.59 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp 50.3 31.93 5.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 124.399 1.062 . . . . 0.0 109.261 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -136.43 173.38 11.77 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.459 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 73.7 m -89.32 149.12 23.18 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.972 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 20' ' ' ASN . 82.7 m-85 -62.96 144.3 56.93 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 121.983 0.897 . . . . 0.0 110.247 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.368 0 O-C-N 119.426 -2.046 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 120.787 0.327 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -97.1 165.45 12.06 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m -49.68 149.68 2.37 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 123.777 0.673 . . . . 0.0 110.843 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.43 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 167.81 13.74 0.02 OUTLIER Glycine 0 N--CA 1.486 2.0 0 CA-C-N 113.697 -1.592 . . . . 0.0 109.797 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.9 t -74.12 147.21 42.91 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.3 t -66.13 96.33 0.32 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 124.327 1.017 . . . . 0.0 108.972 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.6 p -89.62 165.44 14.24 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.388 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.8 m -66.64 -69.32 0.31 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.848 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -164.32 -39.84 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.852 0.72 . . . . 0.0 109.294 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -142.8 23.78 1.89 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.111 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.0 t -55.43 111.71 0.95 Allowed 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.455 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -69.59 -8.09 44.34 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.802 -1.545 . . . . 0.0 111.596 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -58.49 -32.85 69.17 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.834 0.709 . . . . 0.0 109.652 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.4 m -57.23 129.78 43.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 124.204 0.94 . . . . 0.0 111.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.7 m -51.3 -41.41 60.48 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.7 mmm180 -93.75 -80.81 0.38 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.785 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 p -174.11 176.13 2.59 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 123.973 0.796 . . . . 0.0 109.643 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.5 t -97.31 111.15 23.53 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -179.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.57 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 1.1 t-20 -83.33 109.93 17.69 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.637 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -89.02 -43.61 10.99 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.8 p -97.97 6.15 48.02 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 113.93 -1.486 . . . . 0.0 109.442 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.2 pttm 41.93 31.8 0.25 Allowed 'General case' 0 N--CA 1.51 2.562 0 CA-C-O 123.589 1.662 . . . . 0.0 110.007 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -136.42 -178.54 5.21 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 110.514 -3.039 . . . . 0.0 107.643 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.43 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 81.0 m -85.86 144.62 27.6 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.405 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.57 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 65.9 m-85 -58.84 105.57 0.32 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.912 0.863 . . . . 0.0 109.892 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.354 0 O-C-N 119.407 -2.058 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.438 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 10.8 p . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -71.84 159.7 33.84 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.363 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.0 m -55.41 149.12 13.8 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 123.803 0.69 . . . . 0.0 111.415 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 171.48 -3.07 0.03 OUTLIER Glycine 0 N--CA 1.488 2.131 0 CA-C-N 113.619 -1.628 . . . . 0.0 109.255 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.2 m -53.14 123.28 11.33 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.1 p -67.18 80.58 0.13 Allowed 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.709 1.256 . . . . 0.0 113.952 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 5.9 p -109.85 120.06 41.28 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.945 0.878 . . . . 0.0 112.783 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.0 m -112.54 100.94 9.13 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 112.585 -2.098 . . . . 0.0 108.341 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 10.5 mptt 58.48 7.99 0.79 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.156 0.91 . . . . 0.0 112.873 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.6 p -141.19 107.78 5.33 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 123.438 0.461 . . . . 0.0 110.055 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.508 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 41.5 t -157.31 140.98 15.86 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-N 115.077 -0.965 . . . . 0.0 108.476 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -81.25 -53.13 6.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.5 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.429 ' N ' HD21 ' A' ' 14' ' ' ASN . 0.0 OUTLIER -178.45 77.47 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.2 m -68.4 145.39 54.17 Favored 'General case' 0 N--CA 1.5 2.07 0 C-N-CA 119.061 -1.056 . . . . 0.0 111.014 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.438 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.1 m -47.94 -28.57 2.78 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.995 1.434 . . . . 0.0 109.075 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.7 mmm-85 -116.47 -110.86 0.35 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 106.163 -1.792 . . . . 0.0 106.163 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.6 p -173.72 140.63 0.78 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 58.9 m -51.63 103.52 0.06 Allowed 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -76.38 115.06 15.76 Favored 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -89.51 -17.39 28.71 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 124.56 1.162 . . . . 0.0 108.85 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -132.31 2.74 3.9 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.001 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 pttm 40.95 33.4 0.21 Allowed 'General case' 0 N--CA 1.506 2.373 0 O-C-N 124.978 1.424 . . . . 0.0 109.632 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 90.1 mtt-85 -138.36 139.7 39.12 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 111.284 -2.689 . . . . 0.0 108.969 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 67.1 m -65.42 144.17 57.24 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.737 1.256 . . . . 0.0 113.815 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -56.72 164.87 1.34 Allowed 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 111.94 -2.391 . . . . 0.0 111.701 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.462 0 O-C-N 119.945 -1.722 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.408 ' SG ' ' N ' ' A' ' 16' ' ' CYS . 69.2 m . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.498 ' HG3' ' H ' ' A' ' 3' ' ' SER . 52.7 tptt -107.51 -134.53 0.34 Allowed 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.498 ' H ' ' HG3' ' A' ' 2' ' ' LYS . 80.9 p -95.75 163.43 13.18 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -175.63 19.6 0.05 OUTLIER Glycine 0 N--CA 1.486 1.988 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.576 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 29.5 m -64.68 142.0 58.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.4 p -54.92 83.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 125.514 1.759 . . . . 0.0 115.624 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.465 ' SG ' ' OG ' ' A' ' 12' ' ' SER . 40.5 t -143.57 132.7 23.04 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.146 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 41.2 t -79.97 -71.96 0.43 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 114.075 -1.421 . . . . 0.0 113.457 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.426 ' NZ ' ' HB2' ' A' ' 10' ' ' LYS . 4.8 ttmp? -118.91 -46.3 2.54 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.7 t -151.01 125.12 9.3 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.465 ' OG ' ' SG ' ' A' ' 8' ' ' CYS . 72.1 m -138.99 -8.78 1.35 Allowed 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 112.903 -1.953 . . . . 0.0 108.823 179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 60.74 5.93 1.04 Allowed 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 114.479 1.289 . . . . 0.0 114.479 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -82.11 -77.83 0.22 Allowed 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.11 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.576 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 71.3 m -44.34 130.11 6.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 90.3 m -66.12 -15.58 63.23 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.413 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 2.9 mmp_? -90.01 -110.94 0.08 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 61.5 p -161.19 171.53 18.3 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.1 m -100.18 122.29 42.79 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -179.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.471 HD21 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -94.03 117.77 30.56 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . 0.44 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -89.51 17.56 6.21 Favored 'General case' 0 N--CA 1.502 2.168 0 CA-C-O 122.678 1.228 . . . . 0.0 111.425 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.44 ' H ' ' C ' ' A' ' 21' ' ' HYP . 81.2 p -148.7 -9.56 0.35 Allowed 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 112.26 -2.245 . . . . 0.0 105.696 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.405 ' H ' ' H ' ' A' ' 23' ' ' THR . 0.0 OUTLIER 40.46 32.51 0.14 Allowed 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 123.398 1.57 . . . . 0.0 112.137 -179.703 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -132.64 164.97 25.53 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 110.282 -3.145 . . . . 0.0 106.663 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.0 m -85.95 161.5 18.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.349 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -75.02 147.1 41.03 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.823 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.421 0 O-C-N 119.517 -1.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -87.67 162.79 16.9 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.5 p -47.67 145.87 2.52 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 124.007 0.817 . . . . 0.0 112.928 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 166.6 -11.6 0.07 OUTLIER Glycine 0 N--CA 1.485 1.949 0 CA-C-N 113.208 -1.815 . . . . 0.0 110.328 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.522 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 38.5 m -44.6 135.18 5.0 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.8 p -64.22 90.43 0.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 124.579 1.174 . . . . 0.0 113.203 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.7 p -100.69 -155.12 0.5 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.445 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.8 p -154.02 -50.92 0.09 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.037 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -167.37 -35.26 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 124.018 0.824 . . . . 0.0 109.843 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.3 m -115.17 94.14 4.6 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.146 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.8 t -158.65 61.88 0.43 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.036 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -66.6 -15.05 63.16 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.987 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -58.3 -31.49 67.55 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 124.206 0.942 . . . . 0.0 111.568 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.522 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 67.5 m -62.07 130.21 44.46 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.479 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.8 m -39.79 -43.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 125.246 1.591 . . . . 0.0 113.022 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -98.21 -82.69 0.42 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 123.987 0.804 . . . . 0.0 109.32 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.2 p -172.1 168.38 5.82 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 123.485 0.49 . . . . 0.0 110.866 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -91.25 135.76 33.57 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -109.04 105.14 14.52 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 124.902 1.376 . . . . 0.0 108.903 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -89.17 -28.82 19.76 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.5 p -115.65 -1.93 12.59 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.588 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm 54.07 28.92 9.44 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.48 168.35 19.64 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 104.691 -2.337 . . . . 0.0 104.691 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.2 m -93.03 150.23 20.67 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.478 -0.889 . . . . 0.0 113.019 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -61.76 133.4 55.47 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.51 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.396 0 O-C-N 119.766 -1.834 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.467 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 9.8 p . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -89.6 172.91 8.62 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-N 114.389 -1.278 . . . . 0.0 109.908 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 82.6 p -47.9 153.34 0.64 Allowed 'General case' 0 N--CA 1.497 1.897 0 CA-C-N 114.669 -1.15 . . . . 0.0 112.394 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.402 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . -176.74 5.83 0.03 OUTLIER Glycine 0 N--CA 1.479 1.506 0 CA-C-O 118.358 -1.246 . . . . 0.0 111.231 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -57.17 135.81 56.41 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 118.399 1.1 . . . . 0.0 108.123 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 42.4 t -70.87 84.85 0.67 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 124.611 1.194 . . . . 0.0 110.564 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 8.3 p -115.29 142.09 47.14 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -93.69 -172.05 2.77 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 111.988 -2.369 . . . . 0.0 110.169 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -63.56 -19.86 65.16 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -89.82 17.62 6.47 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 123.397 0.436 . . . . 0.0 110.817 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.451 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 45.0 t -158.62 134.23 8.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.696 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.474 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 69.5 m-85 -145.09 27.25 1.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 CA-C-N 113.816 -1.538 . . . . 0.0 107.087 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -54.23 -28.13 39.25 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-N 114.048 -1.433 . . . . 0.0 114.393 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -65.59 155.69 35.02 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.467 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 36.2 m -52.85 -39.85 62.89 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 112.374 -2.194 . . . . 0.0 111.417 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.432 ' N ' ' HD2' ' A' ' 17' ' ' ARG . 2.2 mpt_? -92.54 -89.01 0.2 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.1 p -173.62 -172.99 0.82 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 13' ' ' TYR . 73.9 m -108.72 104.27 13.53 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.4 ' HA ' HD22 ' A' ' 21' ' ' HYP . 2.1 t-20 -68.97 115.25 8.06 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 109.304 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . 0.4 HD22 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -88.69 -47.63 8.11 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.2 p -91.84 -7.72 48.58 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.686 -1.597 . . . . 0.0 108.731 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.409 ' NZ ' ' HB3' ' A' ' 24' ' ' LYS . 6.8 mtpm? 54.26 27.05 7.4 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -133.96 167.63 20.26 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 111.888 -2.415 . . . . 0.0 110.073 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 93.7 m -82.9 154.32 24.65 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.494 1.14 . . . . 0.0 113.852 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -69.29 130.97 44.1 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 112.513 -2.13 . . . . 0.0 108.736 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.383 0 O-C-N 119.388 -2.07 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -99.43 163.12 12.65 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.108 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.9 m -59.33 147.88 34.36 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 163.18 3.94 0.05 OUTLIER Glycine 0 N--CA 1.484 1.862 0 CA-C-N 114.159 -1.382 . . . . 0.0 111.66 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.6 t -66.18 152.41 44.88 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -67.28 88.21 0.18 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 124.285 0.99 . . . . 0.0 111.499 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -93.4 148.65 21.87 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.42 -1.264 . . . . 0.0 111.132 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.6 t -83.09 169.61 15.69 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -53.14 -51.78 60.83 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.602 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.4 t -97.93 59.12 1.41 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.365 1.041 . . . . 0.0 112.883 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.7 p -159.4 85.01 0.78 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.194 0.997 . . . . 0.0 109.647 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -94.38 52.3 1.55 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.227 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.422 ' H ' HD21 ' A' ' 14' ' ' ASN . 3.9 m-80 -64.54 -35.86 82.32 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.065 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 77.1 m -66.08 146.68 54.39 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 124.13 0.894 . . . . 0.0 110.644 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.3 m -58.17 -18.45 25.78 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 123.738 0.649 . . . . 0.0 111.284 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.0 mmm-85 -89.46 -95.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.8 p -174.13 -172.49 0.71 Allowed 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.9 t -119.86 120.83 37.61 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -91.63 106.96 18.87 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -88.74 -49.16 7.02 Favored 'General case' 0 N--CA 1.501 2.108 0 N-CA-C 104.337 -2.468 . . . . 0.0 104.337 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.7 t -89.71 -4.86 57.52 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 112.771 -2.013 . . . . 0.0 107.812 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm 51.18 29.81 5.14 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 122.46 1.124 . . . . 0.0 108.733 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -135.59 157.41 46.95 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 111.839 -2.437 . . . . 0.0 110.025 -179.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.4 m -74.66 163.97 27.11 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.83 0.824 . . . . 0.0 112.369 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -76.75 95.55 4.04 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 113.708 -1.587 . . . . 0.0 109.82 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 119.497 -2.002 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.6 p . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -134.5 -177.11 4.46 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 N--CA 1.501 2.076 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.604 179.958 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.918 0 N-CA-C 109.225 -1.55 . . . . 0.0 109.225 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 t -64.96 138.16 58.19 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.5 m -65.32 91.14 0.11 Allowed 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.381 1.05 . . . . 0.0 113.015 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -89.6 -152.69 0.25 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.203 -1.362 . . . . 0.0 107.542 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.8 t -162.16 -120.0 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.435 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -110.32 -42.23 4.19 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.8 p -89.76 -21.13 22.8 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.273 0.983 . . . . 0.0 111.706 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -72.56 94.96 1.76 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 123.741 0.651 . . . . 0.0 110.583 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -103.42 21.84 15.28 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.654 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -77.94 21.11 0.33 Allowed 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.325 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.8 m -96.15 125.82 40.94 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -63.05 -29.54 70.9 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 119.532 1.06 . . . . 0.0 108.213 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.6 tpt85 -89.35 -85.53 0.2 Allowed 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.1 p -174.66 167.62 3.77 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.836 0.71 . . . . 0.0 109.489 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.2 t -102.42 117.38 34.61 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.403 1.261 . . . . 0.0 114.403 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.448 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 46.2 t30 . . . . . 0 N--CA 1.497 1.908 0 O-C-N 124.433 1.083 . . . . 0.0 108.621 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 . . . . . 0 N--CA 1.498 1.949 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.4 p -108.87 -4.1 17.1 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 113.668 -1.605 . . . . 0.0 109.872 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 53.78 26.2 5.81 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -132.89 161.04 35.27 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 112.506 -2.133 . . . . 0.0 109.893 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.8 m -75.35 141.92 43.25 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 123.659 0.6 . . . . 0.0 112.147 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 80.9 m-85 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.983 0.897 . . . . 0.0 109.749 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.436 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 24.4 p . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 121.223 0.535 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 2' ' ' LYS . 3.3 mmmp? -107.56 -177.43 3.35 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.624 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.2 p . . . . . 0 N--CA 1.501 2.105 0 O-C-N 123.448 0.468 . . . . 0.0 111.245 -179.886 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.499 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 110.627 -0.989 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.488 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 69.9 m -67.96 136.57 54.14 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 120.925 0.393 . . . . 0.0 111.656 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 49.2 m -57.25 93.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.4 p -142.75 127.8 18.5 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.4 t -59.85 171.75 0.87 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.381 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -41.22 -66.16 0.36 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-N 114.063 -1.426 . . . . 0.0 108.595 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 68.5 p -90.04 65.79 6.62 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.084 0.865 . . . . 0.0 111.791 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 m -143.19 25.92 1.69 Allowed 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 114.542 -1.208 . . . . 0.0 107.803 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -55.62 94.59 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.619 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -147.26 0.17 0.7 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.815 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 45.5 m -72.6 168.07 19.39 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.982 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 60.7 m -64.2 -29.62 70.72 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -108.65 -83.75 0.55 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 113.39 -1.732 . . . . 0.0 106.931 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.458 ' OG ' ' CD1' ' A' ' 27' ' ' TYR . 33.1 p -175.63 -175.18 0.75 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 123.965 0.79 . . . . 0.0 108.915 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 98.8 m -106.97 100.52 10.01 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 25' ' ' ARG . 22.1 t-20 . . . . . 0 N--CA 1.494 1.752 0 CA-C-N 112.249 -2.251 . . . . 0.0 108.934 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.6 p90 . . . . . 0 N--CA 1.499 2.008 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 31.3 m -144.05 -7.62 0.72 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt 47.66 36.8 5.92 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.271 0.982 . . . . 0.0 108.931 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HG3' ' N ' ' A' ' 26' ' ' CYS . 10.2 ptt-85 -128.79 -174.68 3.32 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.705 -2.702 . . . . 0.0 103.705 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.558 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 97.3 m -91.32 140.72 29.51 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 118.941 0.791 . . . . 0.0 109.211 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.458 ' CD1' ' OG ' ' A' ' 18' ' ' SER . 19.6 m-85 . . . . . 0 N--CA 1.498 1.971 0 CA-C-O 121.63 0.729 . . . . 0.0 110.299 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.461 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 29.3 p . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.461 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 34.8 mmtp -143.32 175.45 9.89 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.496 1.853 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.853 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.416 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.483 1.786 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.493 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 32.9 t -65.35 145.28 56.38 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.2 p -72.31 103.55 3.44 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 18.7 t -122.74 147.88 45.98 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.184 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.9 m -98.21 -76.29 0.53 Allowed 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.319 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -143.4 -54.66 0.38 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 124.222 0.951 . . . . 0.0 111.037 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -89.43 -5.31 57.5 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.618 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 59.2 m -75.64 87.48 2.72 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -72.1 18.84 0.08 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 114.36 -1.291 . . . . 0.0 113.15 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.426 ' H ' ' C ' ' A' ' 12' ' ' SER . 10.9 m120 -69.43 -2.64 11.6 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.064 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.8 m -96.83 115.88 28.2 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 22.3 m -69.48 -23.92 63.71 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.559 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -89.24 -83.69 0.23 Allowed 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.1 p -175.37 168.14 3.3 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.896 0.747 . . . . 0.0 109.942 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 73.1 m -95.81 116.4 28.85 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 179.909 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.2 p90 . . . . . 0 N--CA 1.503 2.223 0 CA-C-O 122.25 1.024 . . . . 0.0 110.639 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 54.6 m -150.11 -20.96 0.25 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.929 -1.941 . . . . 0.0 106.989 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 49.75 41.51 22.23 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 124.363 1.039 . . . . 0.0 108.497 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -147.59 163.41 36.69 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.493 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 62.1 m -84.83 144.65 28.3 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.46 -0.896 . . . . 0.0 109.346 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 121.928 0.87 . . . . 0.0 110.869 179.591 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.8 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 110.629 -0.137 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.581 ' HD3' ' H ' ' A' ' 3' ' ' SER . 1.8 tmtm? -104.48 146.34 29.01 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.581 ' H ' ' HD3' ' A' ' 2' ' ' LYS . 49.2 m . . . . . 0 N--CA 1.501 2.099 0 O-C-N 123.674 0.608 . . . . 0.0 111.606 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.413 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 49.6 m -81.93 152.28 26.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 54.9 m -63.85 98.48 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.519 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 42.5 t -89.45 103.89 16.49 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.2 m -80.86 -152.32 0.09 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.487 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.454 ' H ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -58.16 -22.2 50.35 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.903 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.4 p -97.71 149.24 22.51 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 m -136.3 9.19 3.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 123.665 0.603 . . . . 0.0 110.807 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -62.37 -17.55 59.29 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.179 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -65.76 -55.72 15.78 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.144 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 75.4 m -95.36 140.42 30.26 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.081 0.863 . . . . 0.0 112.405 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.1 m -66.98 -11.73 57.68 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -89.59 -121.99 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 p -164.49 -174.89 3.63 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.9 m -81.33 109.5 15.89 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 117.705 2.483 . . . . 0.0 117.705 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 27' ' ' TYR . 34.8 t-20 . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.7 p90 . . . . . 0 N--CA 1.502 2.133 0 CA-C-O 122.206 1.003 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.447 ' H ' ' H ' ' A' ' 24' ' ' LYS . 70.4 p -150.14 -17.33 0.25 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.036 -1.893 . . . . 0.0 107.919 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.447 ' H ' ' H ' ' A' ' 23' ' ' THR . 59.9 mttp 56.44 33.19 22.04 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -140.74 178.67 7.18 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.548 -2.569 . . . . 0.0 108.581 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 74.1 m -85.49 167.17 15.7 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 20' ' ' ASN . 69.2 m-85 . . . . . 0 N--CA 1.493 1.685 0 CA-C-O 122.33 1.062 . . . . 0.0 110.863 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.573 0.701 . . . . 0.0 112.111 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -100.95 153.89 19.14 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.789 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.497 1.887 0 O-C-N 124.07 0.856 . . . . 0.0 109.921 179.921 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.99 0 N-CA-C 111.695 -0.562 . . . . 0.0 111.695 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.505 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 34.2 t -70.18 133.38 47.03 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.2 t -68.8 109.1 3.7 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 20.9 p -148.9 149.3 31.02 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 114.761 -1.109 . . . . 0.0 113.267 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 80.3 p -62.48 176.01 0.7 Allowed 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 113.553 -1.658 . . . . 0.0 113.793 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.99 -36.49 49.94 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.1 p -88.62 -139.31 0.12 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 46.3 t 49.97 73.59 0.25 Allowed 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.521 0.677 . . . . 0.0 109.37 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -81.88 40.51 0.61 Allowed 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.422 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -91.59 7.75 39.97 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.995 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 69.6 m -90.87 134.92 34.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 123.571 0.544 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 64.2 m -57.62 -28.19 63.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 -103.82 -85.53 0.46 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 36.3 p 179.28 166.32 1.02 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.659 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 79.5 m -91.68 113.62 25.94 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.433 ' HB2' ' CD1' ' A' ' 27' ' ' TYR . 41.1 t-20 . . . . . 0 N--CA 1.497 1.905 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.547 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 p90 . . . . . 0 N--CA 1.504 2.244 0 CA-C-O 122.44 1.114 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.415 ' CG2' ' HB3' ' A' ' 20' ' ' ASN . 8.4 t -150.72 -16.33 0.23 Allowed 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 113.002 -1.908 . . . . 0.0 107.671 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' THR . 31.2 mmmt 50.31 44.53 26.5 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 122.727 1.251 . . . . 0.0 107.701 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 92.0 mtt-85 -150.14 158.1 43.81 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 110.963 -2.835 . . . . 0.0 108.559 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.505 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 74.1 m -76.3 138.03 40.26 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.751 -0.779 . . . . 0.0 110.434 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 20' ' ' ASN . 84.1 m-85 . . . . . 0 N--CA 1.497 1.875 0 CA-C-O 121.927 0.87 . . . . 0.0 112.101 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.507 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 21.3 p . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -89.79 164.91 14.46 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.495 1.813 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.321 -179.948 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.994 0 CA-C-O 119.002 -0.888 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.62 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 23.4 m -63.46 140.85 58.91 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-N 117.818 0.809 . . . . 0.0 109.49 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.6 m -59.94 95.07 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.482 1.114 . . . . 0.0 113.544 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.486 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 42.9 t -150.38 154.47 37.83 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.003 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.0 m -145.01 54.85 1.22 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.054 -1.43 . . . . 0.0 108.83 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.57 ' H ' ' CB ' ' A' ' 19' ' ' CYS . 32.3 mmmt 68.94 42.36 1.32 Allowed 'General case' 0 N--CA 1.504 2.237 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.413 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 66.1 p -140.42 26.71 2.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 113.444 -1.707 . . . . 0.0 110.752 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.486 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 42.9 t -152.8 -52.53 0.11 Allowed 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 57.58 12.44 1.55 Allowed 'General case' 0 N--CA 1.503 2.183 0 O-C-N 124.505 1.128 . . . . 0.0 111.768 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -75.82 -42.12 50.72 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.323 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.62 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 87.6 m -49.29 144.55 5.23 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 115.999 1.851 . . . . 0.0 115.999 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.507 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 35.0 m -54.63 -42.79 71.66 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 112.44 -2.164 . . . . 0.0 110.861 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.428 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -89.79 -91.72 0.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.3 p -171.81 179.29 2.8 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.57 ' CB ' ' H ' ' A' ' 10' ' ' LYS . 80.1 m -96.09 115.75 27.91 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 . . . . . 0 N--CA 1.498 1.957 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.408 179.843 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 . . . . . 0 N--CA 1.504 2.264 0 CA-C-O 122.129 0.966 . . . . 0.0 108.671 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -119.6 -9.01 9.88 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 112.873 -1.967 . . . . 0.0 107.624 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt 51.45 26.57 3.25 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.81 1.319 . . . . 0.0 108.321 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -133.54 177.99 7.27 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 103.864 -2.643 . . . . 0.0 103.864 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.2 m -95.39 153.46 17.68 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.759 0.79 . . . . 0.0 109.467 179.728 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.421 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 23.1 p . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 121.184 0.516 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -116.3 168.23 10.32 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.732 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.4 p . . . . . 0 N--CA 1.497 1.906 0 CA-C-N 114.448 -1.251 . . . . 0.0 112.31 179.984 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.965 0 CA-C-O 119.684 -0.509 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.5 t -69.02 152.82 44.77 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.3 m -74.29 104.42 5.05 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 117.866 2.543 . . . . 0.0 117.866 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.626 ' SG ' ' N ' ' A' ' 12' ' ' SER . 2.2 t -88.9 137.94 31.86 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.6 t -77.74 78.53 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.9 tttp 63.53 -70.14 0.07 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 113.046 -1.888 . . . . 0.0 110.656 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.1 p -125.32 27.9 6.46 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 123.327 0.392 . . . . 0.0 111.923 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.626 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 90.2 p -68.45 107.17 2.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -74.47 82.54 1.96 Allowed 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.9 p30 -147.09 5.57 0.85 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 112.754 -2.021 . . . . 0.0 109.882 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 72.9 m -95.35 128.25 42.05 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.292 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.421 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.5 m -55.09 -30.66 60.14 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.5 mmm-85 -90.58 -94.08 0.12 Allowed 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 104.821 -2.289 . . . . 0.0 104.821 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 p -177.83 176.09 1.24 Allowed 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.484 ' SG ' ' O ' ' A' ' 12' ' ' SER . 75.3 m -90.66 106.32 18.42 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 116.16 1.911 . . . . 0.0 116.16 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 106.341 -1.725 . . . . 0.0 106.341 179.597 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 . . . . . 0 N--CA 1.503 2.21 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.45 ' OG1' ' HG2' ' A' ' 25' ' ' ARG . 41.4 p -121.25 5.72 10.24 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 112.872 -1.967 . . . . 0.0 109.122 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.13 30.93 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.472 0 O-C-N 125.34 1.65 . . . . 0.0 113.117 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.45 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 15.2 ptm180 -127.32 -168.02 1.82 Allowed 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 112.042 -2.345 . . . . 0.0 105.539 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.5 m -95.34 152.39 18.42 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.614 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 122.195 0.998 . . . . 0.0 111.236 179.508 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.172 0.51 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -84.93 160.25 20.15 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.955 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.0 m . . . . . 0 N--CA 1.496 1.826 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.437 -179.918 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.869 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.3 m -78.76 135.93 37.25 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.9 t -55.18 91.79 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 124.532 1.145 . . . . 0.0 113.609 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.1 -169.46 2.26 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.092 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.0 m -143.22 -50.71 0.34 Allowed 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.019 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.475 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 5.6 ttpm? -167.55 -47.76 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.968 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 t -89.61 68.04 7.6 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.149 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -88.77 39.46 0.92 Allowed 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 114.496 -1.229 . . . . 0.0 113.743 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -62.06 -24.09 66.88 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -57.82 -43.4 85.71 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 114.259 -1.337 . . . . 0.0 108.858 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.5 m -83.75 138.12 33.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 124.526 1.141 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.21 -22.14 65.69 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 123.776 0.672 . . . . 0.0 110.883 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -89.44 -111.81 0.07 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 124.075 0.859 . . . . 0.0 108.814 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.9 p -163.79 -156.35 0.35 Allowed 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 117.751 -1.118 . . . . 0.0 109.173 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.5 t -117.19 109.89 17.47 Favored 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 . . . . . 0 N--CA 1.494 1.77 0 CA-C-N 114.902 -1.044 . . . . 0.0 108.241 179.696 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 . . . . . 0 N--CA 1.502 2.168 0 CA-C-O 122.053 0.93 . . . . 0.0 109.008 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.401 ' OG1' ' HG2' ' A' ' 25' ' ' ARG . 41.4 p -139.1 -9.29 1.31 Allowed 'General case' 0 N--CA 1.492 1.636 0 CA-C-N 113.016 -1.902 . . . . 0.0 108.896 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 7.0 mtpm? 49.34 29.21 2.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.771 1.294 . . . . 0.0 108.469 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.401 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 5.6 ptp180 -130.33 170.22 14.43 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -77.0 152.83 35.03 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 N--CA 1.492 1.647 0 C-N-CA 119.767 -0.773 . . . . 0.0 109.312 179.597 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.545 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 2.5 mppt? -92.32 157.55 16.58 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 54.0 m . . . . . 0 N--CA 1.502 2.126 0 O-C-N 123.23 0.331 . . . . 0.0 111.433 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.928 0 N-CA-C 108.706 -1.758 . . . . 0.0 108.706 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.1 m -65.99 143.35 57.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.8 t -50.64 96.41 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 O-C-N 125.355 1.66 . . . . 0.0 114.455 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 47.9 t -140.71 149.42 42.17 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.588 0.709 . . . . 0.0 111.494 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.1 m -151.8 -65.03 0.18 Allowed 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.472 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 3.8 mmmp? -148.43 19.75 1.06 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 124.847 1.342 . . . . 0.0 109.061 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -114.87 -63.18 1.49 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 123.648 0.593 . . . . 0.0 111.635 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 49.3 m -62.95 143.56 57.61 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 123.915 0.759 . . . . 0.0 109.161 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.411 ' HB2' ' HZ2' ' A' ' 2' ' ' LYS . 97.4 m-85 -67.42 21.98 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.8 m120 68.17 115.51 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.35 1.071 . . . . 0.0 113.887 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 2' ' ' LYS . 72.2 m -57.54 170.49 0.54 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.312 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 99.0 m -53.22 -20.89 4.5 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.587 -0.445 . . . . 0.0 112.026 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -89.52 -76.22 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.6 p 175.19 178.4 0.15 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 124.641 1.213 . . . . 0.0 109.612 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -104.91 120.56 41.73 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.417 ' HB2' ' CE2' ' A' ' 27' ' ' TYR . 36.0 t-20 . . . . . 0 N--CA 1.504 2.259 0 O-C-N 123.957 0.786 . . . . 0.0 109.74 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.401 ' CZ ' ' ND2' ' A' ' 20' ' ' ASN . 50.8 p90 . . . . . 0 N--CA 1.504 2.237 0 CA-C-O 121.791 0.805 . . . . 0.0 112.23 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.3 m -136.16 -11.58 1.94 Allowed 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 106.252 -1.759 . . . . 0.0 106.252 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm 53.29 31.86 12.53 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.417 ' HA ' ' H ' ' A' ' 8' ' ' CYS . 81.4 mtt85 -148.84 178.05 9.0 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.808 -1.996 . . . . 0.0 110.478 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.0 m -95.94 -178.49 4.37 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 20' ' ' ASN . 73.3 m-85 . . . . . 0 N--CA 1.489 1.486 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.548 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.457 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 17.1 p . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 121.276 0.56 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 2' ' ' LYS . 1.8 mppt? -94.9 165.41 12.47 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.602 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p . . . . . 0 N--CA 1.496 1.833 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.542 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.507 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.488 2.14 0 CA-C-O 119.576 -0.569 . . . . 0.0 113.564 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.468 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 32.0 t -64.94 133.29 51.46 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 77.7 p -63.84 84.51 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 23.0 p -126.83 123.95 38.51 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.367 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.5 p -34.44 -101.53 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 118.423 2.749 . . . . 0.0 118.423 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.438 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 0.2 OUTLIER -148.07 -34.42 0.23 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 118.396 0.544 . . . . 0.0 111.827 -179.64 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -89.58 -10.33 46.47 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.47 1.106 . . . . 0.0 110.463 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.1 m -59.21 -65.26 0.7 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.538 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.426 ' N ' ' SG ' ' A' ' 19' ' ' CYS . 36.3 m-85 55.2 19.39 2.87 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 124.064 0.852 . . . . 0.0 110.182 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -58.87 -34.88 72.12 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 92.0 m -69.23 151.01 46.81 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.457 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 46.9 m -44.17 -39.55 4.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 125.557 1.786 . . . . 0.0 108.686 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.421 ' HE ' ' HB3' ' A' ' 27' ' ' TYR . 54.1 ttt85 -89.81 -94.15 0.11 Allowed 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 105.569 -2.012 . . . . 0.0 105.569 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.7 p -171.26 176.36 3.93 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 119.391 0.996 . . . . 0.0 112.691 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 80.5 m -106.22 112.15 25.06 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 123.939 0.775 . . . . 0.0 113.066 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 . . . . . 0 N--CA 1.496 1.843 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.095 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.9 p90 . . . . . 0 N--CA 1.506 2.361 0 CA-C-O 123.035 1.398 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.451 HG23 ' H ' ' A' ' 25' ' ' ARG . 7.8 t -150.9 -13.04 0.22 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 111.653 -2.522 . . . . 0.0 106.471 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? 38.79 41.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 125.241 1.588 . . . . 0.0 110.958 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.483 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.2 ptm180 -139.2 164.22 30.38 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 102.978 -2.971 . . . . 0.0 102.978 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 89.4 m -75.7 165.4 25.11 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 118.51 -1.276 . . . . 0.0 113.183 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.421 ' HB3' ' HE ' ' A' ' 17' ' ' ARG . 80.2 m-85 . . . . . 0 N--CA 1.488 1.443 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.181 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.0 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.475 0.655 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.467 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 11.8 mptt -89.18 179.85 6.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.967 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.6 p . . . . . 0 N--CA 1.496 1.851 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.633 -179.967 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.409 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 67.5 m -64.12 133.3 52.72 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.6 p -58.31 89.04 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 O-C-N 124.947 1.404 . . . . 0.0 114.309 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 38.1 t -89.38 145.74 25.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.828 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.1 p -100.45 46.86 0.94 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp 65.56 -2.37 0.85 Allowed 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.945 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.8 p -143.32 80.46 1.67 Allowed 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.651 0.738 . . . . 0.0 110.805 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.535 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 39.4 t -159.54 82.91 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -76.17 5.17 7.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 114.044 -1.435 . . . . 0.0 110.67 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -55.3 -39.52 70.0 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.372 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 76.2 m -71.14 150.79 45.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.788 0.68 . . . . 0.0 109.904 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 94.3 m -58.56 -35.98 73.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 123.684 0.615 . . . . 0.0 112.142 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -89.73 -101.68 0.1 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 117.808 -1.091 . . . . 0.0 111.523 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.9 p -166.37 -171.73 2.01 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 119.636 1.107 . . . . 0.0 112.152 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 88.7 m -96.39 114.43 26.1 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.827 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 49.5 p90 . . . . . 0 N--CA 1.501 2.102 0 CA-C-O 122.35 1.071 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' LYS . 59.1 m -143.71 -7.81 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' THR . 24.1 pttm 37.71 34.32 0.05 Allowed 'General case' 0 N--CA 1.507 2.396 0 CA-C-O 122.811 1.291 . . . . 0.0 111.563 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.2 mtt85 -142.31 170.86 14.91 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 111.391 -2.64 . . . . 0.0 108.694 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.5 m -84.89 157.76 20.79 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.36 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 . . . . . 0 N--CA 1.49 1.552 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.58 179.438 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.7 p . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.397 0.618 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -84.53 177.64 8.02 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.57 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.494 1.726 0 CA-C-N 115.032 -0.985 . . . . 0.0 113.079 -179.78 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.4 t -56.67 144.51 32.03 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.4 m -66.12 86.09 0.1 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.433 ' SG ' ' OG ' ' A' ' 12' ' ' SER . 37.3 t -89.85 120.14 30.83 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.668 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.7 t -124.02 63.18 1.07 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt 79.66 -49.03 0.38 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-N 112.939 -1.937 . . . . 0.0 109.925 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 70.0 p -89.59 107.97 19.39 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 123.848 0.718 . . . . 0.0 110.992 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.433 ' OG ' ' SG ' ' A' ' 8' ' ' CYS . 89.6 p -169.19 3.94 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.605 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.408 ' H ' ' H ' ' A' ' 12' ' ' SER . 88.7 m-85 56.35 22.0 5.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 123.685 0.616 . . . . 0.0 111.083 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 42.6 t30 63.01 106.21 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.153 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.3 m -59.5 166.17 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.959 -1.473 . . . . 0.0 109.52 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.0 m -36.19 -43.63 0.36 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 124.234 0.959 . . . . 0.0 112.362 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 17' ' ' ARG . 55.5 mtt-85 -101.83 -96.78 0.28 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 107.543 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -168.7 147.28 4.13 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 75.7 m -66.8 143.64 56.78 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.916 -1.947 . . . . 0.0 113.506 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.406 ' HB2' ' CE1' ' A' ' 27' ' ' TYR . 16.5 t-20 . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 . . . . . 0 N--CA 1.499 1.988 0 N-CA-C 103.995 -2.594 . . . . 0.0 103.995 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.7 p -90.01 -10.18 45.86 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.445 -1.707 . . . . 0.0 107.52 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 51.97 33.58 12.05 Favored 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -141.11 152.01 44.41 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 110.742 -2.935 . . . . 0.0 109.464 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 95.6 m -83.47 -178.27 7.0 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.615 0.722 . . . . 0.0 110.108 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 20' ' ' ASN . 19.6 m-85 . . . . . 0 C--N 1.303 -1.438 0 CA-C-N 114.087 -1.415 . . . . 0.0 107.606 179.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.491 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 14.2 p . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 121.02 0.438 . . . . 0.0 112.176 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.452 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 10.1 mtmp? -83.69 -179.08 7.22 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.188 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 N--CA 1.495 1.816 0 CA-C-N 115.019 -0.991 . . . . 0.0 112.28 -179.902 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.486 2.002 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.457 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 61.3 m -64.08 134.04 54.17 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 51.6 m -60.6 90.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 124.696 1.247 . . . . 0.0 114.161 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 28.3 p -149.33 168.28 23.8 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.246 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -169.77 164.02 9.89 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 113.909 -1.496 . . . . 0.0 110.531 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp 48.99 -99.65 0.06 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -89.34 78.72 7.17 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.98 0.895 . . . . 0.0 109.649 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.443 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 59.4 m -155.05 116.11 3.97 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -135.45 84.56 2.1 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -140.1 -48.75 0.45 Allowed 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.779 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 92.9 m -57.51 141.66 46.96 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.491 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.3 m -46.46 -33.7 4.19 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 113.006 -1.906 . . . . 0.0 110.634 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -99.26 -93.34 0.26 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.0 p -174.59 -178.19 1.3 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 76.7 m -98.8 109.28 22.06 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 N--CA 1.499 1.998 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.613 179.875 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 . . . . . 0 N--CA 1.502 2.146 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 74.7 p -90.99 -9.72 44.96 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.835 -1.53 . . . . 0.0 107.556 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 54.69 28.45 10.11 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -139.05 166.52 24.28 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 111.253 -2.703 . . . . 0.0 108.501 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 90.4 m -79.23 154.76 28.96 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 . . . . . 0 N--CA 1.49 1.543 0 CA-C-N 113.442 -1.708 . . . . 0.0 110.566 179.889 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.569 0.699 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.08 147.44 23.72 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 113.655 -1.611 . . . . 0.0 107.775 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 57.5 m . . . . . 0 N--CA 1.498 1.932 0 O-C-N 124.293 0.996 . . . . 0.0 112.359 -179.909 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 CA-C-O 119.438 -0.646 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.488 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 33.1 t -65.06 140.13 58.8 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.2 m -63.59 91.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -106.71 126.24 52.03 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.41 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.5 m -140.71 84.86 1.96 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 124.158 0.911 . . . . 0.0 110.932 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? 52.8 25.94 4.2 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.411 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -145.66 -43.49 0.21 Allowed 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 m -85.0 57.55 4.51 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -80.38 80.64 6.79 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.478 1.133 . . . . 0.0 108.207 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 p30 -162.3 15.34 0.08 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.889 -1.959 . . . . 0.0 109.87 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 81.9 m -65.23 126.31 27.77 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.1 m -45.0 -39.69 5.81 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -94.66 -83.33 0.35 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.7 p -176.62 170.62 2.41 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.813 0.696 . . . . 0.0 110.838 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 87.3 m -94.24 112.67 24.49 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.406 ' HA ' ' CE1' ' A' ' 27' ' ' TYR . 42.5 t-20 . . . . . 0 N--CA 1.497 1.882 0 CA-C-N 114.539 -1.209 . . . . 0.0 107.797 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.2 p90 . . . . . 0 N--CA 1.505 2.308 0 CA-C-O 122.704 1.24 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.0 p -150.11 -15.54 0.25 Allowed 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 112.368 -2.197 . . . . 0.0 107.59 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp 50.3 31.93 5.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 124.399 1.062 . . . . 0.0 109.261 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -136.43 173.38 11.77 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 73.7 m -89.32 149.12 23.18 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.972 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CE1' ' HA ' ' A' ' 20' ' ' ASN . 82.7 m-85 . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 121.983 0.897 . . . . 0.0 110.247 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 120.787 0.327 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -97.1 165.45 12.06 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.498 1.962 0 O-C-N 123.777 0.673 . . . . 0.0 110.843 179.959 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.449 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.486 2.0 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.9 t -74.12 147.21 42.91 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.3 t -66.13 96.33 0.32 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 124.327 1.017 . . . . 0.0 108.972 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.6 p -89.62 165.44 14.24 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.388 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.8 m -66.64 -69.32 0.31 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.848 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -164.32 -39.84 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.852 0.72 . . . . 0.0 109.294 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -142.8 23.78 1.89 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.111 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.0 t -55.43 111.71 0.95 Allowed 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.455 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -69.59 -8.09 44.34 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.802 -1.545 . . . . 0.0 111.596 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -58.49 -32.85 69.17 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.834 0.709 . . . . 0.0 109.652 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.4 m -57.23 129.78 43.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 124.204 0.94 . . . . 0.0 111.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.7 m -51.3 -41.41 60.48 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' HA ' HH11 ' A' ' 17' ' ' ARG . 8.7 mmm180 -93.75 -80.81 0.38 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.785 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.466 ' HG ' ' HD2' ' A' ' 27' ' ' TYR . 33.0 p -174.11 176.13 2.59 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 123.973 0.796 . . . . 0.0 109.643 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.5 t -97.31 111.15 23.53 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -179.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.551 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 1.1 t-20 . . . . . 0 N--CA 1.498 1.968 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.637 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 . . . . . 0 N--CA 1.498 1.954 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.8 p -97.97 6.15 48.02 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 113.93 -1.486 . . . . 0.0 109.442 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.2 pttm 41.93 31.8 0.25 Allowed 'General case' 0 N--CA 1.51 2.562 0 CA-C-O 123.589 1.662 . . . . 0.0 110.007 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -136.42 -178.54 5.21 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 110.514 -3.039 . . . . 0.0 107.643 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.449 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 81.0 m -85.86 144.62 27.6 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.405 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.551 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 65.9 m-85 . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 121.912 0.863 . . . . 0.0 109.892 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.48 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 10.8 p . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -71.84 159.7 33.84 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.363 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.497 1.901 0 O-C-N 123.803 0.69 . . . . 0.0 111.415 -179.849 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.131 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.2 m -53.14 123.28 11.33 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.1 p -67.18 80.58 0.13 Allowed 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.709 1.256 . . . . 0.0 113.952 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 5.9 p -109.85 120.06 41.28 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.945 0.878 . . . . 0.0 112.783 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.0 m -112.54 100.94 9.13 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 112.585 -2.098 . . . . 0.0 108.341 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.512 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 10.5 mptt 58.48 7.99 0.79 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.156 0.91 . . . . 0.0 112.873 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.6 p -141.19 107.78 5.33 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 123.438 0.461 . . . . 0.0 110.055 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.529 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 41.5 t -157.31 140.98 15.86 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-N 115.077 -0.965 . . . . 0.0 108.476 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -81.25 -53.13 6.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.5 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -178.45 77.47 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.2 m -68.4 145.39 54.17 Favored 'General case' 0 N--CA 1.5 2.07 0 C-N-CA 119.061 -1.056 . . . . 0.0 111.014 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.48 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.1 m -47.94 -28.57 2.78 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.995 1.434 . . . . 0.0 109.075 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.7 mmm-85 -116.47 -110.86 0.35 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 106.163 -1.792 . . . . 0.0 106.163 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.6 p -173.72 140.63 0.78 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.529 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 58.9 m -51.63 103.52 0.06 Allowed 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 35.3 t30 . . . . . 0 N--CA 1.495 1.801 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 N--CA 1.499 2.014 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -132.31 2.74 3.9 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.001 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 pttm 40.95 33.4 0.21 Allowed 'General case' 0 N--CA 1.506 2.373 0 O-C-N 124.978 1.424 . . . . 0.0 109.632 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 20' ' ' ASN . 90.1 mtt-85 -138.36 139.7 39.12 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 111.284 -2.689 . . . . 0.0 108.969 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 67.1 m -65.42 144.17 57.24 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.737 1.256 . . . . 0.0 113.815 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 . . . . . 0 N--CA 1.492 1.628 0 CA-C-N 111.94 -2.391 . . . . 0.0 111.701 179.955 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.408 ' SG ' ' N ' ' A' ' 16' ' ' CYS . 69.2 m . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.553 ' HG3' ' H ' ' A' ' 3' ' ' SER . 52.7 tptt -107.51 -134.53 0.34 Allowed 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.553 ' H ' ' HG3' ' A' ' 2' ' ' LYS . 80.9 p . . . . . 0 N--CA 1.496 1.848 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.988 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.57 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 29.5 m -64.68 142.0 58.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.4 p -54.92 83.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 125.514 1.759 . . . . 0.0 115.624 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.5 t -143.57 132.7 23.04 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.146 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 41.2 t -79.97 -71.96 0.43 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 114.075 -1.421 . . . . 0.0 113.457 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 10' ' ' LYS . 4.8 ttmp? -118.91 -46.3 2.54 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.7 t -151.01 125.12 9.3 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.1 m -138.99 -8.78 1.35 Allowed 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 112.903 -1.953 . . . . 0.0 108.823 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 60.74 5.93 1.04 Allowed 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 114.479 1.289 . . . . 0.0 114.479 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -82.11 -77.83 0.22 Allowed 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.11 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 71.3 m -44.34 130.11 6.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.408 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 90.3 m -66.12 -15.58 63.23 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.461 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 2.9 mmp_? -90.01 -110.94 0.08 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 61.5 p -161.19 171.53 18.3 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.1 m -100.18 122.29 42.79 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -179.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 . . . . . 0 N--CA 1.497 1.908 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.701 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.0 p90 . . . . . 0 N--CA 1.502 2.168 0 CA-C-O 122.678 1.228 . . . . 0.0 111.425 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.2 p -148.7 -9.56 0.35 Allowed 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 112.26 -2.245 . . . . 0.0 105.696 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 40.46 32.51 0.14 Allowed 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 123.398 1.57 . . . . 0.0 112.137 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -132.64 164.97 25.53 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 110.282 -3.145 . . . . 0.0 106.663 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.0 m -85.95 161.5 18.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.349 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 N--CA 1.49 1.534 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.823 179.646 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.405 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 26.8 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -87.67 162.79 16.9 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.5 p . . . . . 0 N--CA 1.495 1.82 0 O-C-N 124.007 0.817 . . . . 0.0 112.928 -179.872 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.949 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.523 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 38.5 m -44.6 135.18 5.0 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.8 p -64.22 90.43 0.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 124.579 1.174 . . . . 0.0 113.203 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.7 p -100.69 -155.12 0.5 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.445 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.8 p -154.02 -50.92 0.09 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.037 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -167.37 -35.26 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 124.018 0.824 . . . . 0.0 109.843 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.3 m -115.17 94.14 4.6 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.146 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.8 t -158.65 61.88 0.43 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.036 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -66.6 -15.05 63.16 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.987 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -58.3 -31.49 67.55 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 124.206 0.942 . . . . 0.0 111.568 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 67.5 m -62.07 130.21 44.46 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.479 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.405 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 60.8 m -39.79 -43.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 125.246 1.591 . . . . 0.0 113.022 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -98.21 -82.69 0.42 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 123.987 0.804 . . . . 0.0 109.32 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.2 p -172.1 168.38 5.82 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 123.485 0.49 . . . . 0.0 110.866 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -91.25 135.76 33.57 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 . . . . . 0 N--CA 1.498 1.94 0 O-C-N 124.902 1.376 . . . . 0.0 108.903 179.798 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.5 p -115.65 -1.93 12.59 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.588 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm 54.07 28.92 9.44 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.48 168.35 19.64 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 104.691 -2.337 . . . . 0.0 104.691 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.2 m -93.03 150.23 20.67 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.478 -0.889 . . . . 0.0 113.019 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 . . . . . 0 N--CA 1.488 1.443 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.51 179.873 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.523 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 9.8 p . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -89.6 172.91 8.62 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-N 114.389 -1.278 . . . . 0.0 109.908 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 82.6 p . . . . . 0 N--CA 1.497 1.897 0 CA-C-N 114.669 -1.15 . . . . 0.0 112.394 179.865 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.425 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.479 1.506 0 CA-C-O 118.358 -1.246 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -57.17 135.81 56.41 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 118.399 1.1 . . . . 0.0 108.123 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 42.4 t -70.87 84.85 0.67 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 124.611 1.194 . . . . 0.0 110.564 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 8.3 p -115.29 142.09 47.14 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -93.69 -172.05 2.77 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 111.988 -2.369 . . . . 0.0 110.169 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 10' ' ' LYS . 2.1 mppt? -63.56 -19.86 65.16 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -89.82 17.62 6.47 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 123.397 0.436 . . . . 0.0 110.817 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.451 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 45.0 t -158.62 134.23 8.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.696 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.47 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 69.5 m-85 -145.09 27.25 1.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 CA-C-N 113.816 -1.538 . . . . 0.0 107.087 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -54.23 -28.13 39.25 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-N 114.048 -1.433 . . . . 0.0 114.393 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -65.59 155.69 35.02 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.523 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 36.2 m -52.85 -39.85 62.89 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 112.374 -2.194 . . . . 0.0 111.417 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.47 ' N ' ' HD2' ' A' ' 17' ' ' ARG . 2.2 mpt_? -92.54 -89.01 0.2 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.1 p -173.62 -172.99 0.82 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.47 ' SG ' ' HA ' ' A' ' 13' ' ' TYR . 73.9 m -108.72 104.27 13.53 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.495 1.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 109.304 179.674 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 . . . . . 0 N--CA 1.498 1.97 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.2 p -91.84 -7.72 48.58 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.686 -1.597 . . . . 0.0 108.731 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 6.8 mtpm? 54.26 27.05 7.4 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -133.96 167.63 20.26 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 111.888 -2.415 . . . . 0.0 110.073 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 93.7 m -82.9 154.32 24.65 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.494 1.14 . . . . 0.0 113.852 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 . . . . . 0 C--N 1.303 -1.455 0 CA-C-N 112.513 -2.13 . . . . 0.0 108.736 179.756 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -99.43 163.12 12.65 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.108 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 N--CA 1.496 1.848 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.771 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.416 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.484 1.862 0 CA-C-O 119.251 -0.749 . . . . 0.0 111.66 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.6 t -66.18 152.41 44.88 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -67.28 88.21 0.18 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 124.285 0.99 . . . . 0.0 111.499 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -93.4 148.65 21.87 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.42 -1.264 . . . . 0.0 111.132 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.6 t -83.09 169.61 15.69 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -53.14 -51.78 60.83 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.602 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.4 t -97.93 59.12 1.41 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.365 1.041 . . . . 0.0 112.883 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.7 p -159.4 85.01 0.78 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.194 0.997 . . . . 0.0 109.647 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -94.38 52.3 1.55 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.227 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -64.54 -35.86 82.32 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.065 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 77.1 m -66.08 146.68 54.39 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 124.13 0.894 . . . . 0.0 110.644 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.3 m -58.17 -18.45 25.78 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 123.738 0.649 . . . . 0.0 111.284 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.0 mmm-85 -89.46 -95.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.8 p -174.13 -172.49 0.71 Allowed 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 41.9 t -119.86 120.83 37.61 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 . . . . . 0 N--CA 1.493 1.72 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 179.875 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 . . . . . 0 N--CA 1.501 2.108 0 N-CA-C 104.337 -2.468 . . . . 0.0 104.337 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.419 HG23 ' H ' ' A' ' 25' ' ' ARG . 4.7 t -89.71 -4.86 57.52 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 112.771 -2.013 . . . . 0.0 107.812 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm 51.18 29.81 5.14 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 122.46 1.124 . . . . 0.0 108.733 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.419 ' H ' HG23 ' A' ' 23' ' ' THR . 52.6 mtp180 -135.59 157.41 46.95 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 111.839 -2.437 . . . . 0.0 110.025 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.416 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 95.4 m -74.66 163.97 27.11 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.83 0.824 . . . . 0.0 112.369 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 . . . . . 0 N--CA 1.488 1.445 0 CA-C-N 113.708 -1.587 . . . . 0.0 109.82 179.765 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.6 p . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -134.5 -177.11 4.46 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 5' ' ' GLY . 50.0 m -63.77 159.65 18.94 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.604 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' H ' ' H ' ' A' ' 6' ' ' SER . . . -178.9 10.61 0.03 OUTLIER Glycine 0 N--CA 1.485 1.918 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.225 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.414 ' H ' ' H ' ' A' ' 5' ' ' GLY . 33.4 t -64.96 138.16 58.19 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.5 m -65.32 91.14 0.11 Allowed 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.381 1.05 . . . . 0.0 113.015 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -89.6 -152.69 0.25 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.203 -1.362 . . . . 0.0 107.542 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.8 t -162.16 -120.0 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.435 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -110.32 -42.23 4.19 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.8 p -89.76 -21.13 22.8 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.273 0.983 . . . . 0.0 111.706 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -72.56 94.96 1.76 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 123.741 0.651 . . . . 0.0 110.583 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -103.42 21.84 15.28 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.654 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -77.94 21.11 0.33 Allowed 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.325 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.8 m -96.15 125.82 40.94 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -63.05 -29.54 70.9 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 119.532 1.06 . . . . 0.0 108.213 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.6 tpt85 -89.35 -85.53 0.2 Allowed 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.1 p -174.66 167.62 3.77 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.836 0.71 . . . . 0.0 109.489 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.2 t -102.42 117.38 34.61 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.403 1.261 . . . . 0.0 114.403 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.448 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 46.2 t30 -89.6 111.22 22.1 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 124.433 1.083 . . . . 0.0 108.621 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -89.44 -34.59 16.4 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.4 p -108.87 -4.1 17.1 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 113.668 -1.605 . . . . 0.0 109.872 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 53.78 26.2 5.81 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -132.89 161.04 35.27 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 112.506 -2.133 . . . . 0.0 109.893 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.8 m -75.35 141.92 43.25 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 123.659 0.6 . . . . 0.0 112.147 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 80.9 m-85 -59.45 149.58 29.09 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.983 0.897 . . . . 0.0 109.749 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.462 0 O-C-N 119.49 -2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.436 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 24.4 p . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 121.223 0.535 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 2' ' ' LYS . 3.3 mmmp? -107.56 -177.43 3.35 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.624 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.2 p -60.28 161.05 7.6 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 123.448 0.468 . . . . 0.0 111.245 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HYP . . . . . 0.409 ' HB2' ' HD3' ' A' ' 17' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.499 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 179.73 8.67 0.02 OUTLIER Glycine 0 N--CA 1.479 1.516 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.627 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.488 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 69.9 m -67.96 136.57 54.14 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 120.925 0.393 . . . . 0.0 111.656 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 49.2 m -57.25 93.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.4 p -142.75 127.8 18.5 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.4 t -59.85 171.75 0.87 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.381 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.439 ' HG2' ' HB2' ' A' ' 21' ' ' HYP . 5.6 tmtt? -41.22 -66.16 0.36 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-N 114.063 -1.426 . . . . 0.0 108.595 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 68.5 p -90.04 65.79 6.62 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.084 0.865 . . . . 0.0 111.791 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 m -143.19 25.92 1.69 Allowed 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 114.542 -1.208 . . . . 0.0 107.803 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -55.62 94.59 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.619 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -147.26 0.17 0.7 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.815 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 45.5 m -72.6 168.07 19.39 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.982 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.436 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 60.7 m -64.2 -29.62 70.72 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.409 ' HD3' ' HB2' ' A' ' 4' ' ' HYP . 74.6 mtp85 -108.65 -83.75 0.55 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 113.39 -1.732 . . . . 0.0 106.931 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.458 ' OG ' ' CD1' ' A' ' 27' ' ' TYR . 33.1 p -175.63 -175.18 0.75 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 123.965 0.79 . . . . 0.0 108.915 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 98.8 m -106.97 100.52 10.01 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 25' ' ' ARG . 22.1 t-20 -48.61 111.33 0.45 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 112.249 -2.251 . . . . 0.0 108.934 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HYP . . . . . 0.439 ' HB2' ' HG2' ' A' ' 10' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -89.11 12.71 14.95 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 124.352 1.033 . . . . 0.0 112.356 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 31.3 m -144.05 -7.62 0.72 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt 47.66 36.8 5.92 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.271 0.982 . . . . 0.0 108.931 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HG3' ' N ' ' A' ' 26' ' ' CYS . 10.2 ptt-85 -128.79 -174.68 3.32 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.705 -2.702 . . . . 0.0 103.705 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.558 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 97.3 m -91.32 140.72 29.51 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 118.941 0.791 . . . . 0.0 109.211 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.458 ' CD1' ' OG ' ' A' ' 18' ' ' SER . 19.6 m-85 -50.58 134.43 24.25 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 121.63 0.729 . . . . 0.0 110.299 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.44 0 O-C-N 119.17 -2.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.461 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 29.3 p . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.461 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 34.8 mmtp -143.32 175.45 9.89 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.8 p -65.53 153.6 41.02 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.506 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 155.03 5.68 0.09 OUTLIER Glycine 0 N--CA 1.483 1.786 0 CA-C-N 113.715 -1.584 . . . . 0.0 111.604 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.493 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 32.9 t -65.35 145.28 56.38 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.2 p -72.31 103.55 3.44 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 18.7 t -122.74 147.88 45.98 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.184 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.9 m -98.21 -76.29 0.53 Allowed 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.319 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -143.4 -54.66 0.38 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 124.222 0.951 . . . . 0.0 111.037 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -89.43 -5.31 57.5 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.618 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 59.2 m -75.64 87.48 2.72 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -72.1 18.84 0.08 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 114.36 -1.291 . . . . 0.0 113.15 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.426 ' H ' ' C ' ' A' ' 12' ' ' SER . 10.9 m120 -69.43 -2.64 11.6 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.064 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.8 m -96.83 115.88 28.2 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 22.3 m -69.48 -23.92 63.71 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.559 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -89.24 -83.69 0.23 Allowed 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.1 p -175.37 168.14 3.3 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.896 0.747 . . . . 0.0 109.942 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 73.1 m -95.81 116.4 28.85 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -94.99 111.17 22.99 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HYP . . . . . 0.444 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -89.57 23.96 2.45 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-O 122.25 1.024 . . . . 0.0 110.639 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 21' ' ' HYP . 54.6 m -150.11 -20.96 0.25 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.929 -1.941 . . . . 0.0 106.989 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 49.75 41.51 22.23 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 124.363 1.039 . . . . 0.0 108.497 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -147.59 163.41 36.69 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.506 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 62.1 m -84.83 144.65 28.3 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.46 -0.896 . . . . 0.0 109.346 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -58.89 150.09 25.16 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.928 0.87 . . . . 0.0 110.869 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.421 0 O-C-N 119.586 -1.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.8 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 110.629 -0.137 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.581 ' HD3' ' H ' ' A' ' 3' ' ' SER . 1.8 tmtm? -104.48 146.34 29.01 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.581 ' H ' ' HD3' ' A' ' 2' ' ' LYS . 49.2 m -44.49 144.37 1.08 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 123.674 0.608 . . . . 0.0 111.606 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.87 21.67 0.02 OUTLIER Glycine 0 N--CA 1.486 2.025 0 CA-C-N 113.933 -1.485 . . . . 0.0 110.94 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.413 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 49.6 m -81.93 152.28 26.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 54.9 m -63.85 98.48 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.519 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 42.5 t -89.45 103.89 16.49 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.2 m -80.86 -152.32 0.09 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.487 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.454 ' H ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -58.16 -22.2 50.35 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.903 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.4 p -97.71 149.24 22.51 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 m -136.3 9.19 3.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 123.665 0.603 . . . . 0.0 110.807 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -62.37 -17.55 59.29 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.179 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -65.76 -55.72 15.78 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.144 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 75.4 m -95.36 140.42 30.26 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.081 0.863 . . . . 0.0 112.405 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.1 m -66.98 -11.73 57.68 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -89.59 -121.99 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 p -164.49 -174.89 3.63 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.9 m -81.33 109.5 15.89 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 117.705 2.483 . . . . 0.0 117.705 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HA ' ' CZ ' ' A' ' 27' ' ' TYR . 34.8 t-20 -90.54 106.48 18.53 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 179.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -88.91 25.14 1.86 Allowed 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 122.206 1.003 . . . . 0.0 111.892 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.447 ' H ' ' H ' ' A' ' 24' ' ' LYS . 70.4 p -150.14 -17.33 0.25 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.036 -1.893 . . . . 0.0 107.919 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.447 ' H ' ' H ' ' A' ' 23' ' ' THR . 59.9 mttp 56.44 33.19 22.04 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -140.74 178.67 7.18 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.548 -2.569 . . . . 0.0 108.581 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 74.1 m -85.49 167.17 15.7 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 20' ' ' ASN . 69.2 m-85 -74.93 85.03 2.24 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 122.33 1.062 . . . . 0.0 110.863 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.424 0 O-C-N 119.581 -1.95 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.573 0.701 . . . . 0.0 112.111 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -100.95 153.89 19.14 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.789 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.3 t -57.24 146.57 27.96 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 124.07 0.856 . . . . 0.0 109.921 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.535 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 84.75 8.18 83.12 Favored Glycine 0 N--CA 1.486 1.99 0 O-C-N 125.02 1.45 . . . . 0.0 111.695 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.505 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 34.2 t -70.18 133.38 47.03 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.2 t -68.8 109.1 3.7 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 20.9 p -148.9 149.3 31.02 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 114.761 -1.109 . . . . 0.0 113.267 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 80.3 p -62.48 176.01 0.7 Allowed 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 113.553 -1.658 . . . . 0.0 113.793 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.99 -36.49 49.94 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.1 p -88.62 -139.31 0.12 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 46.3 t 49.97 73.59 0.25 Allowed 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.521 0.677 . . . . 0.0 109.37 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -81.88 40.51 0.61 Allowed 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.422 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -91.59 7.75 39.97 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.995 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 69.6 m -90.87 134.92 34.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 123.571 0.544 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 64.2 m -57.62 -28.19 63.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 -103.82 -85.53 0.46 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 36.3 p 179.28 166.32 1.02 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.659 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 79.5 m -91.68 113.62 25.94 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.462 ' HA ' HD23 ' A' ' 21' ' ' HYP . 41.1 t-20 -88.2 123.92 33.31 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.547 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HYP . . . . . 0.462 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -88.91 23.92 2.22 Favored 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 122.44 1.114 . . . . 0.0 112.537 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.415 ' CG2' ' HB3' ' A' ' 20' ' ' ASN . 8.4 t -150.72 -16.33 0.23 Allowed 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 113.002 -1.908 . . . . 0.0 107.671 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' THR . 31.2 mmmt 50.31 44.53 26.5 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 122.727 1.251 . . . . 0.0 107.701 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 92.0 mtt-85 -150.14 158.1 43.81 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 110.963 -2.835 . . . . 0.0 108.559 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.535 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 74.1 m -76.3 138.03 40.26 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.751 -0.779 . . . . 0.0 110.434 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 20' ' ' ASN . 84.1 m-85 -46.15 141.65 3.22 Favored 'General case' 0 N--CA 1.497 1.875 0 CA-C-O 121.927 0.87 . . . . 0.0 112.101 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.384 0 O-C-N 119.532 -1.98 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.507 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 21.3 p . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -89.79 164.91 14.46 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 77.9 p -51.9 147.93 6.45 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.321 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.494 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 139.69 7.35 1.03 Allowed Glycine 0 N--CA 1.486 1.994 0 O-C-N 125.321 1.638 . . . . 0.0 111.755 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.62 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 23.4 m -63.46 140.85 58.91 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-N 117.818 0.809 . . . . 0.0 109.49 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.6 m -59.94 95.07 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.482 1.114 . . . . 0.0 113.544 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.486 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 42.9 t -150.38 154.47 37.83 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.003 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.0 m -145.01 54.85 1.22 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.054 -1.43 . . . . 0.0 108.83 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.57 ' H ' ' CB ' ' A' ' 19' ' ' CYS . 32.3 mmmt 68.94 42.36 1.32 Allowed 'General case' 0 N--CA 1.504 2.237 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.413 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 66.1 p -140.42 26.71 2.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 113.444 -1.707 . . . . 0.0 110.752 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.486 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 42.9 t -152.8 -52.53 0.11 Allowed 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 57.58 12.44 1.55 Allowed 'General case' 0 N--CA 1.503 2.183 0 O-C-N 124.505 1.128 . . . . 0.0 111.768 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -75.82 -42.12 50.72 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.323 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.62 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 87.6 m -49.29 144.55 5.23 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 115.999 1.851 . . . . 0.0 115.999 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.507 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 35.0 m -54.63 -42.79 71.66 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 112.44 -2.164 . . . . 0.0 110.861 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.428 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -89.79 -91.72 0.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.3 p -171.81 179.29 2.8 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.57 ' CB ' ' H ' ' A' ' 10' ' ' LYS . 80.1 m -96.09 115.75 27.91 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.408 ' HA ' HD23 ' A' ' 21' ' ' HYP . 53.7 t-20 -92.46 109.05 20.43 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.408 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HYP . . . . . 0.408 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -88.77 -18.8 26.99 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-O 122.129 0.966 . . . . 0.0 108.671 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -119.6 -9.01 9.88 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 112.873 -1.967 . . . . 0.0 107.624 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt 51.45 26.57 3.25 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.81 1.319 . . . . 0.0 108.321 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -133.54 177.99 7.27 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 103.864 -2.643 . . . . 0.0 103.864 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 89.2 m -95.39 153.46 17.68 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -65.12 152.76 42.75 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.759 0.79 . . . . 0.0 109.467 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.416 0 O-C-N 119.594 -1.941 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.421 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 23.1 p . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 121.184 0.516 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -116.3 168.23 10.32 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.732 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.4 p -56.15 161.53 2.38 Favored 'General case' 0 N--CA 1.497 1.906 0 CA-C-N 114.448 -1.251 . . . . 0.0 112.31 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.88 4.37 85.55 Favored Glycine 0 N--CA 1.485 1.965 0 O-C-N 124.884 1.365 . . . . 0.0 112.145 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.5 t -69.02 152.82 44.77 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.3 m -74.29 104.42 5.05 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 117.866 2.543 . . . . 0.0 117.866 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.626 ' SG ' ' N ' ' A' ' 12' ' ' SER . 2.2 t -88.9 137.94 31.86 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.6 t -77.74 78.53 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.9 tttp 63.53 -70.14 0.07 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 113.046 -1.888 . . . . 0.0 110.656 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.1 p -125.32 27.9 6.46 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 123.327 0.392 . . . . 0.0 111.923 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.626 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 90.2 p -68.45 107.17 2.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -74.47 82.54 1.96 Allowed 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.9 p30 -147.09 5.57 0.85 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 112.754 -2.021 . . . . 0.0 109.882 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 72.9 m -95.35 128.25 42.05 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.292 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.421 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.5 m -55.09 -30.66 60.14 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.5 mmm-85 -90.58 -94.08 0.12 Allowed 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 104.821 -2.289 . . . . 0.0 104.821 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 p -177.83 176.09 1.24 Allowed 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.484 ' SG ' ' O ' ' A' ' 12' ' ' SER . 75.3 m -90.66 106.32 18.42 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 116.16 1.911 . . . . 0.0 116.16 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -84.29 109.08 17.53 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.341 -1.725 . . . . 0.0 106.341 179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -88.92 -24.29 22.5 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.45 ' OG1' ' HG2' ' A' ' 25' ' ' ARG . 41.4 p -121.25 5.72 10.24 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 112.872 -1.967 . . . . 0.0 109.122 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.13 30.93 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.472 0 O-C-N 125.34 1.65 . . . . 0.0 113.117 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.45 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 15.2 ptm180 -127.32 -168.02 1.82 Allowed 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 112.042 -2.345 . . . . 0.0 105.539 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.5 m -95.34 152.39 18.42 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.614 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -65.6 167.38 9.09 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 122.195 0.998 . . . . 0.0 111.236 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.424 0 O-C-N 119.838 -1.789 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.172 0.51 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -84.93 160.25 20.15 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.955 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.0 m -58.34 146.95 32.72 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.437 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 147.04 19.95 0.11 Allowed Glycine 0 N--CA 1.484 1.869 0 CA-C-N 113.645 -1.616 . . . . 0.0 110.982 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.3 m -78.76 135.93 37.25 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.9 t -55.18 91.79 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 124.532 1.145 . . . . 0.0 113.609 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.1 -169.46 2.26 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.092 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.0 m -143.22 -50.71 0.34 Allowed 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.019 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.475 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 5.6 ttpm? -167.55 -47.76 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.968 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 t -89.61 68.04 7.6 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.149 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -88.77 39.46 0.92 Allowed 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 114.496 -1.229 . . . . 0.0 113.743 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -62.06 -24.09 66.88 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -57.82 -43.4 85.71 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 114.259 -1.337 . . . . 0.0 108.858 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.5 m -83.75 138.12 33.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 124.526 1.141 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.21 -22.14 65.69 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 123.776 0.672 . . . . 0.0 110.883 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -89.44 -111.81 0.07 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 124.075 0.859 . . . . 0.0 108.814 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.9 p -163.79 -156.35 0.35 Allowed 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 117.751 -1.118 . . . . 0.0 109.173 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.5 t -117.19 109.89 17.47 Favored 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -82.42 113.53 20.24 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 114.902 -1.044 . . . . 0.0 108.241 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -88.93 -4.27 58.5 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 124.397 1.061 . . . . 0.0 109.008 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.401 ' OG1' ' HG2' ' A' ' 25' ' ' ARG . 41.4 p -139.1 -9.29 1.31 Allowed 'General case' 0 N--CA 1.492 1.636 0 CA-C-N 113.016 -1.902 . . . . 0.0 108.896 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 7.0 mtpm? 49.34 29.21 2.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.771 1.294 . . . . 0.0 108.469 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.401 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 5.6 ptp180 -130.33 170.22 14.43 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -77.0 152.83 35.03 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -67.68 154.24 41.91 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.767 -0.773 . . . . 0.0 109.312 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.415 0 O-C-N 119.797 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.545 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 2.5 mppt? -92.32 157.55 16.58 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 54.0 m -57.65 150.97 18.19 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 123.23 0.331 . . . . 0.0 111.433 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.469 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 142.89 7.93 0.59 Allowed Glycine 0 N--CA 1.485 1.928 0 CA-C-N 112.982 -1.917 . . . . 0.0 108.706 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.1 m -65.99 143.35 57.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.8 t -50.64 96.41 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 O-C-N 125.355 1.66 . . . . 0.0 114.455 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 47.9 t -140.71 149.42 42.17 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.588 0.709 . . . . 0.0 111.494 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.1 m -151.8 -65.03 0.18 Allowed 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.472 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 3.8 mmmp? -148.43 19.75 1.06 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 124.847 1.342 . . . . 0.0 109.061 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -114.87 -63.18 1.49 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 123.648 0.593 . . . . 0.0 111.635 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 49.3 m -62.95 143.56 57.61 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 123.915 0.759 . . . . 0.0 109.161 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.411 ' HB2' ' HZ2' ' A' ' 2' ' ' LYS . 97.4 m-85 -67.42 21.98 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.8 m120 68.17 115.51 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.35 1.071 . . . . 0.0 113.887 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 2' ' ' LYS . 72.2 m -57.54 170.49 0.54 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.312 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 99.0 m -53.22 -20.89 4.5 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.587 -0.445 . . . . 0.0 112.026 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -89.52 -76.22 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.6 p 175.19 178.4 0.15 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 124.641 1.213 . . . . 0.0 109.612 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -104.91 120.56 41.73 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.417 ' HB2' ' CE2' ' A' ' 27' ' ' TYR . 36.0 t-20 -99.93 109.11 21.48 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 123.957 0.786 . . . . 0.0 109.74 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.401 ' CZ ' ' ND2' ' A' ' 20' ' ' ASN . 50.8 p90 -89.13 18.29 5.14 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 124.027 0.829 . . . . 0.0 112.23 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.3 m -136.16 -11.58 1.94 Allowed 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 106.252 -1.759 . . . . 0.0 106.252 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm 53.29 31.86 12.53 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.417 ' HA ' ' H ' ' A' ' 8' ' ' CYS . 81.4 mtt85 -148.84 178.05 9.0 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.808 -1.996 . . . . 0.0 110.478 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.469 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 62.0 m -95.94 -178.49 4.37 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 20' ' ' ASN . 73.3 m-85 -95.13 171.55 8.67 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.548 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.506 0 O-C-N 119.917 -1.739 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.457 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 17.1 p . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 121.276 0.56 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 2' ' ' LYS . 1.8 mppt? -94.9 165.41 12.47 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.602 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -62.75 155.95 25.15 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.542 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.507 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 70.43 8.93 63.65 Favored Glycine 0 N--CA 1.488 2.14 0 O-C-N 125.168 1.542 . . . . 0.0 113.564 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.468 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 32.0 t -64.94 133.29 51.46 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 77.7 p -63.84 84.51 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -179.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 23.0 p -126.83 123.95 38.51 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.367 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.5 p -34.44 -101.53 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 118.423 2.749 . . . . 0.0 118.423 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.438 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 0.2 OUTLIER -148.07 -34.42 0.23 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 118.396 0.544 . . . . 0.0 111.827 -179.64 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -89.58 -10.33 46.47 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.47 1.106 . . . . 0.0 110.463 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.1 m -59.21 -65.26 0.7 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.538 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.426 ' N ' ' SG ' ' A' ' 19' ' ' CYS . 36.3 m-85 55.2 19.39 2.87 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 124.064 0.852 . . . . 0.0 110.182 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -58.87 -34.88 72.12 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 92.0 m -69.23 151.01 46.81 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.457 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 46.9 m -44.17 -39.55 4.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 125.557 1.786 . . . . 0.0 108.686 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.421 ' HE ' ' HB3' ' A' ' 27' ' ' TYR . 54.1 ttt85 -89.81 -94.15 0.11 Allowed 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 105.569 -2.012 . . . . 0.0 105.569 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.7 p -171.26 176.36 3.93 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 119.391 0.996 . . . . 0.0 112.691 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 80.5 m -106.22 112.15 25.06 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 123.939 0.775 . . . . 0.0 113.066 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.463 ' HA ' HD23 ' A' ' 21' ' ' HYP . 8.3 t-20 -83.96 131.09 34.87 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.095 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HYP . . . . . 0.463 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -89.04 21.25 3.22 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 123.035 1.398 . . . . 0.0 112.918 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.451 HG23 ' H ' ' A' ' 25' ' ' ARG . 7.8 t -150.9 -13.04 0.22 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 111.653 -2.522 . . . . 0.0 106.471 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? 38.79 41.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 125.241 1.588 . . . . 0.0 110.958 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.483 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.2 ptm180 -139.2 164.22 30.38 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 102.978 -2.971 . . . . 0.0 102.978 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 89.4 m -75.7 165.4 25.11 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 118.51 -1.276 . . . . 0.0 113.183 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.421 ' HB3' ' HE ' ' A' ' 17' ' ' ARG . 80.2 m-85 -76.23 166.34 23.6 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.181 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.456 0 O-C-N 119.864 -1.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.0 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.475 0.655 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.467 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 11.8 mptt -89.18 179.85 6.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.967 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.6 p -63.33 154.87 30.42 Favored 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.633 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.79 18.92 0.04 OUTLIER Glycine 0 N--CA 1.482 1.701 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.409 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 67.5 m -64.12 133.3 52.72 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.6 p -58.31 89.04 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 O-C-N 124.947 1.404 . . . . 0.0 114.309 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 38.1 t -89.38 145.74 25.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.828 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.1 p -100.45 46.86 0.94 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp 65.56 -2.37 0.85 Allowed 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.945 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.8 p -143.32 80.46 1.67 Allowed 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.651 0.738 . . . . 0.0 110.805 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.535 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 39.4 t -159.54 82.91 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -76.17 5.17 7.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 114.044 -1.435 . . . . 0.0 110.67 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -55.3 -39.52 70.0 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.372 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 76.2 m -71.14 150.79 45.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.788 0.68 . . . . 0.0 109.904 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 94.3 m -58.56 -35.98 73.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 123.684 0.615 . . . . 0.0 112.142 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -89.73 -101.68 0.1 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 117.808 -1.091 . . . . 0.0 111.523 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.9 p -166.37 -171.73 2.01 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 119.636 1.107 . . . . 0.0 112.152 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 88.7 m -96.39 114.43 26.1 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -92.21 110.48 21.87 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -89.4 16.11 8.08 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 122.35 1.071 . . . . 0.0 110.945 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' LYS . 59.1 m -143.71 -7.81 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' THR . 24.1 pttm 37.71 34.32 0.05 Allowed 'General case' 0 N--CA 1.507 2.396 0 CA-C-O 122.811 1.291 . . . . 0.0 111.563 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.2 mtt85 -142.31 170.86 14.91 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 111.391 -2.64 . . . . 0.0 108.694 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.5 m -84.89 157.76 20.79 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.36 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -73.1 157.91 36.36 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.58 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.421 0 O-C-N 119.854 -1.779 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.7 p . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.397 0.618 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -84.53 177.64 8.02 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.57 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m -53.88 136.07 41.21 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 115.032 -0.985 . . . . 0.0 113.079 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 97.64 -7.67 63.49 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.4 t -56.67 144.51 32.03 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.4 m -66.12 86.09 0.1 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.433 ' SG ' ' OG ' ' A' ' 12' ' ' SER . 37.3 t -89.85 120.14 30.83 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.668 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.7 t -124.02 63.18 1.07 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt 79.66 -49.03 0.38 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-N 112.939 -1.937 . . . . 0.0 109.925 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 70.0 p -89.59 107.97 19.39 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 123.848 0.718 . . . . 0.0 110.992 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.433 ' OG ' ' SG ' ' A' ' 8' ' ' CYS . 89.6 p -169.19 3.94 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.605 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.408 ' H ' ' H ' ' A' ' 12' ' ' SER . 88.7 m-85 56.35 22.0 5.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 123.685 0.616 . . . . 0.0 111.083 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 42.6 t30 63.01 106.21 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.153 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.3 m -59.5 166.17 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.959 -1.473 . . . . 0.0 109.52 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.0 m -36.19 -43.63 0.36 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 124.234 0.959 . . . . 0.0 112.362 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 17' ' ' ARG . 55.5 mtt-85 -101.83 -96.78 0.28 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 107.543 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -168.7 147.28 4.13 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 75.7 m -66.8 143.64 56.78 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.916 -1.947 . . . . 0.0 113.506 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.406 ' HB2' ' CE1' ' A' ' 27' ' ' TYR . 16.5 t-20 -131.95 104.6 6.93 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -88.58 -47.86 7.99 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 103.995 -2.594 . . . . 0.0 103.995 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.7 p -90.01 -10.18 45.86 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.445 -1.707 . . . . 0.0 107.52 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 51.97 33.58 12.05 Favored 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -141.11 152.01 44.41 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 110.742 -2.935 . . . . 0.0 109.464 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 95.6 m -83.47 -178.27 7.0 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.615 0.722 . . . . 0.0 110.108 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 20' ' ' ASN . 19.6 m-85 -95.64 153.06 17.91 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 114.087 -1.415 . . . . 0.0 107.606 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.362 0 O-C-N 119.912 -1.743 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.491 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 14.2 p . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 121.02 0.438 . . . . 0.0 112.176 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.452 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 10.1 mtmp? -83.69 -179.08 7.22 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.188 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.7 p -58.99 151.35 22.24 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 115.019 -0.991 . . . . 0.0 112.28 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 174.84 8.78 0.02 OUTLIER Glycine 0 N--CA 1.486 2.002 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.44 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.457 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 61.3 m -64.08 134.04 54.17 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 51.6 m -60.6 90.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 124.696 1.247 . . . . 0.0 114.161 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 28.3 p -149.33 168.28 23.8 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.246 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -169.77 164.02 9.89 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 113.909 -1.496 . . . . 0.0 110.531 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp 48.99 -99.65 0.06 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -89.34 78.72 7.17 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.98 0.895 . . . . 0.0 109.649 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.443 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 59.4 m -155.05 116.11 3.97 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -135.45 84.56 2.1 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -140.1 -48.75 0.45 Allowed 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.779 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 92.9 m -57.51 141.66 46.96 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.491 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.3 m -46.46 -33.7 4.19 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 113.006 -1.906 . . . . 0.0 110.634 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -99.26 -93.34 0.26 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.0 p -174.59 -178.19 1.3 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 76.7 m -98.8 109.28 22.06 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.435 ' HA ' HD23 ' A' ' 21' ' ' HYP . 27.4 t-20 -79.86 109.49 14.33 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.613 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HYP . . . . . 0.435 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -88.79 -41.05 12.75 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 74.7 p -90.99 -9.72 44.96 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.835 -1.53 . . . . 0.0 107.556 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 54.69 28.45 10.11 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -139.05 166.52 24.28 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 111.253 -2.703 . . . . 0.0 108.501 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 90.4 m -79.23 154.76 28.96 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -61.77 98.62 0.1 Allowed 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 113.442 -1.708 . . . . 0.0 110.566 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.394 0 O-C-N 119.614 -1.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.569 0.699 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.08 147.44 23.72 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 113.655 -1.611 . . . . 0.0 107.775 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 57.5 m -53.07 157.16 1.87 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.293 0.996 . . . . 0.0 112.359 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.421 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 76.87 9.0 86.77 Favored Glycine 0 N--CA 1.489 2.218 0 O-C-N 124.759 1.287 . . . . 0.0 112.249 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.488 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 33.1 t -65.06 140.13 58.8 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.2 m -63.59 91.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -106.71 126.24 52.03 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.41 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.5 m -140.71 84.86 1.96 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 124.158 0.911 . . . . 0.0 110.932 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? 52.8 25.94 4.2 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.411 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -145.66 -43.49 0.21 Allowed 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 m -85.0 57.55 4.51 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -80.38 80.64 6.79 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.478 1.133 . . . . 0.0 108.207 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 p30 -162.3 15.34 0.08 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.889 -1.959 . . . . 0.0 109.87 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 81.9 m -65.23 126.31 27.77 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.1 m -45.0 -39.69 5.81 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -94.66 -83.33 0.35 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.7 p -176.62 170.62 2.41 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.813 0.696 . . . . 0.0 110.838 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 87.3 m -94.24 112.67 24.49 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.438 ' HA ' HD23 ' A' ' 21' ' ' HYP . 42.5 t-20 -87.86 116.38 25.98 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 114.539 -1.209 . . . . 0.0 107.797 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HYP . . . . . 0.452 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -88.83 25.13 1.85 Allowed 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 122.704 1.24 . . . . 0.0 111.423 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.452 ' H ' ' C ' ' A' ' 21' ' ' HYP . 65.0 p -150.11 -15.54 0.25 Allowed 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 112.368 -2.197 . . . . 0.0 107.59 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp 50.3 31.93 5.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 124.399 1.062 . . . . 0.0 109.261 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -136.43 173.38 11.77 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 73.7 m -89.32 149.12 23.18 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.972 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CE1' ' HA ' ' A' ' 20' ' ' ASN . 82.7 m-85 -62.96 144.3 56.93 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 121.983 0.897 . . . . 0.0 110.247 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.368 0 O-C-N 119.426 -2.046 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 120.787 0.327 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -97.1 165.45 12.06 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m -49.68 149.68 2.37 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 123.777 0.673 . . . . 0.0 110.843 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.449 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 167.81 13.74 0.02 OUTLIER Glycine 0 N--CA 1.486 2.0 0 CA-C-N 113.697 -1.592 . . . . 0.0 109.797 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.429 ' H ' ' H ' ' A' ' 5' ' ' GLY . 31.9 t -74.12 147.21 42.91 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.3 t -66.13 96.33 0.32 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 124.327 1.017 . . . . 0.0 108.972 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.6 p -89.62 165.44 14.24 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.388 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.8 m -66.64 -69.32 0.31 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.848 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -164.32 -39.84 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.852 0.72 . . . . 0.0 109.294 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -142.8 23.78 1.89 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.111 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.0 t -55.43 111.71 0.95 Allowed 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.455 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -69.59 -8.09 44.34 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.802 -1.545 . . . . 0.0 111.596 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -58.49 -32.85 69.17 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.834 0.709 . . . . 0.0 109.652 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.4 m -57.23 129.78 43.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 124.204 0.94 . . . . 0.0 111.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.7 m -51.3 -41.41 60.48 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' HA ' HH11 ' A' ' 17' ' ' ARG . 8.7 mmm180 -93.75 -80.81 0.38 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.785 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.466 ' HG ' ' HD2' ' A' ' 27' ' ' TYR . 33.0 p -174.11 176.13 2.59 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 123.973 0.796 . . . . 0.0 109.643 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.5 t -97.31 111.15 23.53 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -179.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.551 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 46.5 t30 -83.33 109.93 17.69 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.637 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -89.02 -43.61 10.99 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.8 p -97.97 6.15 48.02 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 113.93 -1.486 . . . . 0.0 109.442 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.2 pttm 41.93 31.8 0.25 Allowed 'General case' 0 N--CA 1.51 2.562 0 CA-C-O 123.589 1.662 . . . . 0.0 110.007 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -136.42 -178.54 5.21 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 110.514 -3.039 . . . . 0.0 107.643 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.449 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 81.0 m -85.86 144.62 27.6 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.405 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.551 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 65.9 m-85 -58.84 105.57 0.32 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.912 0.863 . . . . 0.0 109.892 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.354 0 O-C-N 119.407 -2.058 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.48 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 10.8 p . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -71.84 159.7 33.84 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.363 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.0 m -55.41 149.12 13.8 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 123.803 0.69 . . . . 0.0 111.415 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.421 ' H ' ' H ' ' A' ' 6' ' ' SER . . . 171.48 -3.07 0.03 OUTLIER Glycine 0 N--CA 1.488 2.131 0 CA-C-N 113.619 -1.628 . . . . 0.0 109.255 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.421 ' H ' ' H ' ' A' ' 5' ' ' GLY . 69.2 m -53.14 123.28 11.33 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.1 p -67.18 80.58 0.13 Allowed 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.709 1.256 . . . . 0.0 113.952 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 5.9 p -109.85 120.06 41.28 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.945 0.878 . . . . 0.0 112.783 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.0 m -112.54 100.94 9.13 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 112.585 -2.098 . . . . 0.0 108.341 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.512 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 10.5 mptt 58.48 7.99 0.79 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.156 0.91 . . . . 0.0 112.873 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.6 p -141.19 107.78 5.33 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 123.438 0.461 . . . . 0.0 110.055 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.529 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 41.5 t -157.31 140.98 15.86 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-N 115.077 -0.965 . . . . 0.0 108.476 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -81.25 -53.13 6.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.5 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -178.45 77.47 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.2 m -68.4 145.39 54.17 Favored 'General case' 0 N--CA 1.5 2.07 0 C-N-CA 119.061 -1.056 . . . . 0.0 111.014 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.48 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.1 m -47.94 -28.57 2.78 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.995 1.434 . . . . 0.0 109.075 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.7 mmm-85 -116.47 -110.86 0.35 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 106.163 -1.792 . . . . 0.0 106.163 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.6 p -173.72 140.63 0.78 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.529 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 58.9 m -51.63 103.52 0.06 Allowed 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 35.3 t30 -76.38 115.06 15.76 Favored 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -89.51 -17.39 28.71 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 124.56 1.162 . . . . 0.0 108.85 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -132.31 2.74 3.9 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.001 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 pttm 40.95 33.4 0.21 Allowed 'General case' 0 N--CA 1.506 2.373 0 O-C-N 124.978 1.424 . . . . 0.0 109.632 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 20' ' ' ASN . 90.1 mtt-85 -138.36 139.7 39.12 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 111.284 -2.689 . . . . 0.0 108.969 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 67.1 m -65.42 144.17 57.24 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.737 1.256 . . . . 0.0 113.815 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -56.72 164.87 1.34 Allowed 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 111.94 -2.391 . . . . 0.0 111.701 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.462 0 O-C-N 119.945 -1.722 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.408 ' SG ' ' N ' ' A' ' 16' ' ' CYS . 69.2 m . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.553 ' HG3' ' H ' ' A' ' 3' ' ' SER . 52.7 tptt -107.51 -134.53 0.34 Allowed 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.553 ' H ' ' HG3' ' A' ' 2' ' ' LYS . 80.9 p -95.75 163.43 13.18 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -175.63 19.6 0.05 OUTLIER Glycine 0 N--CA 1.486 1.988 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.57 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 29.5 m -64.68 142.0 58.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.4 p -54.92 83.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 125.514 1.759 . . . . 0.0 115.624 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.5 t -143.57 132.7 23.04 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.146 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 41.2 t -79.97 -71.96 0.43 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 114.075 -1.421 . . . . 0.0 113.457 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 10' ' ' LYS . 4.8 ttmp? -118.91 -46.3 2.54 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.7 t -151.01 125.12 9.3 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.1 m -138.99 -8.78 1.35 Allowed 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 112.903 -1.953 . . . . 0.0 108.823 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 60.74 5.93 1.04 Allowed 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 114.479 1.289 . . . . 0.0 114.479 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -82.11 -77.83 0.22 Allowed 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.11 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 71.3 m -44.34 130.11 6.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 90.3 m -66.12 -15.58 63.23 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.461 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 2.9 mmp_? -90.01 -110.94 0.08 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 61.5 p -161.19 171.53 18.3 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.1 m -100.18 122.29 42.79 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -179.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.419 ' HA ' HD23 ' A' ' 21' ' ' HYP . 35.8 t-20 -94.03 117.77 30.56 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' HYP . . . . . 0.419 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -89.51 17.56 6.21 Favored 'General case' 0 N--CA 1.502 2.168 0 CA-C-O 122.678 1.228 . . . . 0.0 111.425 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.405 ' H ' ' C ' ' A' ' 21' ' ' HYP . 81.2 p -148.7 -9.56 0.35 Allowed 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 112.26 -2.245 . . . . 0.0 105.696 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 40.46 32.51 0.14 Allowed 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 123.398 1.57 . . . . 0.0 112.137 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -132.64 164.97 25.53 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 110.282 -3.145 . . . . 0.0 106.663 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.0 m -85.95 161.5 18.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.349 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -75.02 147.1 41.03 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.823 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.421 0 O-C-N 119.517 -1.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.405 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 26.8 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -87.67 162.79 16.9 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.5 p -47.67 145.87 2.52 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 124.007 0.817 . . . . 0.0 112.928 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 166.6 -11.6 0.07 OUTLIER Glycine 0 N--CA 1.485 1.949 0 CA-C-N 113.208 -1.815 . . . . 0.0 110.328 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.523 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 38.5 m -44.6 135.18 5.0 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.8 p -64.22 90.43 0.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 124.579 1.174 . . . . 0.0 113.203 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.7 p -100.69 -155.12 0.5 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.445 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.8 p -154.02 -50.92 0.09 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.037 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -167.37 -35.26 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 124.018 0.824 . . . . 0.0 109.843 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.3 m -115.17 94.14 4.6 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.146 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.8 t -158.65 61.88 0.43 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.036 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -66.6 -15.05 63.16 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.987 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -58.3 -31.49 67.55 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 124.206 0.942 . . . . 0.0 111.568 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 67.5 m -62.07 130.21 44.46 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.479 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.405 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 60.8 m -39.79 -43.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 125.246 1.591 . . . . 0.0 113.022 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -98.21 -82.69 0.42 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 123.987 0.804 . . . . 0.0 109.32 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.2 p -172.1 168.38 5.82 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 123.485 0.49 . . . . 0.0 110.866 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -91.25 135.76 33.57 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -109.04 105.14 14.52 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 124.902 1.376 . . . . 0.0 108.903 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -89.17 -28.82 19.76 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.5 p -115.65 -1.93 12.59 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.588 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm 54.07 28.92 9.44 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.48 168.35 19.64 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 104.691 -2.337 . . . . 0.0 104.691 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.2 m -93.03 150.23 20.67 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.478 -0.889 . . . . 0.0 113.019 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -61.76 133.4 55.47 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.51 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.396 0 O-C-N 119.766 -1.834 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.523 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 9.8 p . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -89.6 172.91 8.62 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-N 114.389 -1.278 . . . . 0.0 109.908 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 82.6 p -47.9 153.34 0.64 Allowed 'General case' 0 N--CA 1.497 1.897 0 CA-C-N 114.669 -1.15 . . . . 0.0 112.394 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.425 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . -176.74 5.83 0.03 OUTLIER Glycine 0 N--CA 1.479 1.506 0 CA-C-O 118.358 -1.246 . . . . 0.0 111.231 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -57.17 135.81 56.41 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 118.399 1.1 . . . . 0.0 108.123 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 42.4 t -70.87 84.85 0.67 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 124.611 1.194 . . . . 0.0 110.564 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 8.3 p -115.29 142.09 47.14 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -93.69 -172.05 2.77 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 111.988 -2.369 . . . . 0.0 110.169 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 10' ' ' LYS . 2.1 mppt? -63.56 -19.86 65.16 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -89.82 17.62 6.47 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 123.397 0.436 . . . . 0.0 110.817 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.451 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 45.0 t -158.62 134.23 8.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.696 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.47 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 69.5 m-85 -145.09 27.25 1.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 CA-C-N 113.816 -1.538 . . . . 0.0 107.087 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -54.23 -28.13 39.25 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-N 114.048 -1.433 . . . . 0.0 114.393 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -65.59 155.69 35.02 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.523 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 36.2 m -52.85 -39.85 62.89 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 112.374 -2.194 . . . . 0.0 111.417 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.47 ' N ' ' HD2' ' A' ' 17' ' ' ARG . 2.2 mpt_? -92.54 -89.01 0.2 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.1 p -173.62 -172.99 0.82 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.47 ' SG ' ' HA ' ' A' ' 13' ' ' TYR . 73.9 m -108.72 104.27 13.53 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -68.97 115.25 8.06 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 109.304 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -88.69 -47.63 8.11 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.2 p -91.84 -7.72 48.58 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.686 -1.597 . . . . 0.0 108.731 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 6.8 mtpm? 54.26 27.05 7.4 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -133.96 167.63 20.26 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 111.888 -2.415 . . . . 0.0 110.073 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 93.7 m -82.9 154.32 24.65 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.494 1.14 . . . . 0.0 113.852 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -69.29 130.97 44.1 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 112.513 -2.13 . . . . 0.0 108.736 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.383 0 O-C-N 119.388 -2.07 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -99.43 163.12 12.65 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.108 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.9 m -59.33 147.88 34.36 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.416 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 163.18 3.94 0.05 OUTLIER Glycine 0 N--CA 1.484 1.862 0 CA-C-N 114.159 -1.382 . . . . 0.0 111.66 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.6 t -66.18 152.41 44.88 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -67.28 88.21 0.18 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 124.285 0.99 . . . . 0.0 111.499 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -93.4 148.65 21.87 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.42 -1.264 . . . . 0.0 111.132 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.6 t -83.09 169.61 15.69 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -53.14 -51.78 60.83 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.602 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.4 t -97.93 59.12 1.41 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.365 1.041 . . . . 0.0 112.883 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.7 p -159.4 85.01 0.78 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.194 0.997 . . . . 0.0 109.647 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -94.38 52.3 1.55 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.227 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -64.54 -35.86 82.32 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.065 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 77.1 m -66.08 146.68 54.39 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 124.13 0.894 . . . . 0.0 110.644 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.3 m -58.17 -18.45 25.78 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 123.738 0.649 . . . . 0.0 111.284 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.0 mmm-85 -89.46 -95.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.8 p -174.13 -172.49 0.71 Allowed 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 41.9 t -119.86 120.83 37.61 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.423 ' HA ' HD23 ' A' ' 21' ' ' HYP . 45.1 t-20 -91.63 106.96 18.87 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' HYP . . . . . 0.423 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -88.74 -49.16 7.02 Favored 'General case' 0 N--CA 1.501 2.108 0 N-CA-C 104.337 -2.468 . . . . 0.0 104.337 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.419 HG23 ' H ' ' A' ' 25' ' ' ARG . 4.7 t -89.71 -4.86 57.52 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 112.771 -2.013 . . . . 0.0 107.812 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm 51.18 29.81 5.14 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 122.46 1.124 . . . . 0.0 108.733 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.419 ' H ' HG23 ' A' ' 23' ' ' THR . 52.6 mtp180 -135.59 157.41 46.95 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 111.839 -2.437 . . . . 0.0 110.025 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.416 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 95.4 m -74.66 163.97 27.11 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.83 0.824 . . . . 0.0 112.369 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -76.75 95.55 4.04 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 113.708 -1.587 . . . . 0.0 109.82 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 119.497 -2.002 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.6 p . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -134.5 -177.11 4.46 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 N--CA 1.501 2.076 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.604 179.958 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.918 0 N-CA-C 109.225 -1.55 . . . . 0.0 109.225 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.4 t -64.96 138.16 58.19 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.5 m -65.32 91.14 0.11 Allowed 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.381 1.05 . . . . 0.0 113.015 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -89.6 -152.69 0.25 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.203 -1.362 . . . . 0.0 107.542 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.8 t -162.16 -120.0 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.435 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -110.32 -42.23 4.19 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.8 p -89.76 -21.13 22.8 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.273 0.983 . . . . 0.0 111.706 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -72.56 94.96 1.76 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 123.741 0.651 . . . . 0.0 110.583 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -103.42 21.84 15.28 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.654 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -77.94 21.11 0.33 Allowed 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.325 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.8 m -96.15 125.82 40.94 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -63.05 -29.54 70.9 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 119.532 1.06 . . . . 0.0 108.213 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.6 tpt85 -89.35 -85.53 0.2 Allowed 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.1 p -174.66 167.62 3.77 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.836 0.71 . . . . 0.0 109.489 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.2 t -102.42 117.38 34.61 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.403 1.261 . . . . 0.0 114.403 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.448 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 46.2 t30 . . . . . 0 N--CA 1.497 1.908 0 O-C-N 124.433 1.083 . . . . 0.0 108.621 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 . . . . . 0 N--CA 1.498 1.949 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.4 p -108.87 -4.1 17.1 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 113.668 -1.605 . . . . 0.0 109.872 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 53.78 26.2 5.81 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -132.89 161.04 35.27 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 112.506 -2.133 . . . . 0.0 109.893 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.8 m -75.35 141.92 43.25 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 123.659 0.6 . . . . 0.0 112.147 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 80.9 m-85 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.983 0.897 . . . . 0.0 109.749 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.436 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 24.4 p . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 121.223 0.535 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 2' ' ' LYS . 3.3 mmmp? -107.56 -177.43 3.35 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.624 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.2 p . . . . . 0 N--CA 1.501 2.105 0 O-C-N 123.448 0.468 . . . . 0.0 111.245 -179.886 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.499 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 110.627 -0.989 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.488 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 69.9 m -67.96 136.57 54.14 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 120.925 0.393 . . . . 0.0 111.656 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 49.2 m -57.25 93.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.4 p -142.75 127.8 18.5 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.4 t -59.85 171.75 0.87 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.381 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -41.22 -66.16 0.36 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-N 114.063 -1.426 . . . . 0.0 108.595 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 68.5 p -90.04 65.79 6.62 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.084 0.865 . . . . 0.0 111.791 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 m -143.19 25.92 1.69 Allowed 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 114.542 -1.208 . . . . 0.0 107.803 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -55.62 94.59 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.619 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -147.26 0.17 0.7 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.815 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 45.5 m -72.6 168.07 19.39 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.982 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.436 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 60.7 m -64.2 -29.62 70.72 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -108.65 -83.75 0.55 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 113.39 -1.732 . . . . 0.0 106.931 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.458 ' OG ' ' CD1' ' A' ' 27' ' ' TYR . 33.1 p -175.63 -175.18 0.75 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 123.965 0.79 . . . . 0.0 108.915 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 98.8 m -106.97 100.52 10.01 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.494 1.752 0 CA-C-N 112.249 -2.251 . . . . 0.0 108.934 179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.6 p90 . . . . . 0 N--CA 1.499 2.008 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 31.3 m -144.05 -7.62 0.72 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt 47.66 36.8 5.92 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.271 0.982 . . . . 0.0 108.931 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HG3' ' N ' ' A' ' 26' ' ' CYS . 10.2 ptt-85 -128.79 -174.68 3.32 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.705 -2.702 . . . . 0.0 103.705 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.558 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 97.3 m -91.32 140.72 29.51 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 118.941 0.791 . . . . 0.0 109.211 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.458 ' CD1' ' OG ' ' A' ' 18' ' ' SER . 19.6 m-85 . . . . . 0 N--CA 1.498 1.971 0 CA-C-O 121.63 0.729 . . . . 0.0 110.299 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.461 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 29.3 p . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.461 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 34.8 mmtp -143.32 175.45 9.89 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.496 1.853 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.853 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.416 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.483 1.786 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.493 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 32.9 t -65.35 145.28 56.38 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.2 p -72.31 103.55 3.44 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 18.7 t -122.74 147.88 45.98 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.184 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.9 m -98.21 -76.29 0.53 Allowed 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.319 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -143.4 -54.66 0.38 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 124.222 0.951 . . . . 0.0 111.037 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -89.43 -5.31 57.5 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.618 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 59.2 m -75.64 87.48 2.72 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -72.1 18.84 0.08 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 114.36 -1.291 . . . . 0.0 113.15 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.426 ' H ' ' C ' ' A' ' 12' ' ' SER . 9.1 m-80 -69.43 -2.64 11.6 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.064 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.8 m -96.83 115.88 28.2 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 22.3 m -69.48 -23.92 63.71 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.559 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -89.24 -83.69 0.23 Allowed 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.1 p -175.37 168.14 3.3 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.896 0.747 . . . . 0.0 109.942 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 73.1 m -95.81 116.4 28.85 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.454 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.2 p90 . . . . . 0 N--CA 1.503 2.223 0 CA-C-O 122.25 1.024 . . . . 0.0 110.639 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 54.6 m -150.11 -20.96 0.25 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.929 -1.941 . . . . 0.0 106.989 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 49.75 41.51 22.23 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 124.363 1.039 . . . . 0.0 108.497 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -147.59 163.41 36.69 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.493 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 62.1 m -84.83 144.65 28.3 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.46 -0.896 . . . . 0.0 109.346 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 121.928 0.87 . . . . 0.0 110.869 179.591 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.8 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 110.629 -0.137 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.581 ' HD3' ' H ' ' A' ' 3' ' ' SER . 1.8 tmtm? -104.48 146.34 29.01 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.581 ' H ' ' HD3' ' A' ' 2' ' ' LYS . 49.2 m . . . . . 0 N--CA 1.501 2.099 0 O-C-N 123.674 0.608 . . . . 0.0 111.606 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.025 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.413 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 49.6 m -81.93 152.28 26.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 54.9 m -63.85 98.48 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.519 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 42.5 t -89.45 103.89 16.49 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.2 m -80.86 -152.32 0.09 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.487 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.454 ' H ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -58.16 -22.2 50.35 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.903 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.4 p -97.71 149.24 22.51 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 m -136.3 9.19 3.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 123.665 0.603 . . . . 0.0 110.807 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -62.37 -17.55 59.29 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.179 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -65.76 -55.72 15.78 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.144 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 75.4 m -95.36 140.42 30.26 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.081 0.863 . . . . 0.0 112.405 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.1 m -66.98 -11.73 57.68 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -89.59 -121.99 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 p -164.49 -174.89 3.63 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.9 m -81.33 109.5 15.89 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 117.705 2.483 . . . . 0.0 117.705 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.497 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 179.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.7 p90 . . . . . 0 N--CA 1.502 2.133 0 CA-C-O 122.206 1.003 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.447 ' H ' ' H ' ' A' ' 24' ' ' LYS . 70.4 p -150.14 -17.33 0.25 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.036 -1.893 . . . . 0.0 107.919 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.447 ' H ' ' H ' ' A' ' 23' ' ' THR . 59.9 mttp 56.44 33.19 22.04 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -140.74 178.67 7.18 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.548 -2.569 . . . . 0.0 108.581 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 74.1 m -85.49 167.17 15.7 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 20' ' ' ASN . 69.2 m-85 . . . . . 0 N--CA 1.493 1.685 0 CA-C-O 122.33 1.062 . . . . 0.0 110.863 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.573 0.701 . . . . 0.0 112.111 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -100.95 153.89 19.14 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.789 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.497 1.887 0 O-C-N 124.07 0.856 . . . . 0.0 109.921 179.921 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.99 0 N-CA-C 111.695 -0.562 . . . . 0.0 111.695 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.505 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 34.2 t -70.18 133.38 47.03 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.2 t -68.8 109.1 3.7 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 20.9 p -148.9 149.3 31.02 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 114.761 -1.109 . . . . 0.0 113.267 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 80.3 p -62.48 176.01 0.7 Allowed 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 113.553 -1.658 . . . . 0.0 113.793 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.99 -36.49 49.94 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.1 p -88.62 -139.31 0.12 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 46.3 t 49.97 73.59 0.25 Allowed 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.521 0.677 . . . . 0.0 109.37 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -81.88 40.51 0.61 Allowed 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.422 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -91.59 7.75 39.97 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.995 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 69.6 m -90.87 134.92 34.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 123.571 0.544 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 64.2 m -57.62 -28.19 63.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 -103.82 -85.53 0.46 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 36.3 p 179.28 166.32 1.02 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.659 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 79.5 m -91.68 113.62 25.94 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.518 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.905 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.547 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 p90 . . . . . 0 N--CA 1.504 2.244 0 CA-C-O 122.44 1.114 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.415 ' CG2' ' HB3' ' A' ' 20' ' ' ASN . 8.4 t -150.72 -16.33 0.23 Allowed 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 113.002 -1.908 . . . . 0.0 107.671 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' THR . 31.2 mmmt 50.31 44.53 26.5 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 122.727 1.251 . . . . 0.0 107.701 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 92.0 mtt-85 -150.14 158.1 43.81 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 110.963 -2.835 . . . . 0.0 108.559 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.505 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 74.1 m -76.3 138.03 40.26 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.751 -0.779 . . . . 0.0 110.434 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 20' ' ' ASN . 84.1 m-85 . . . . . 0 N--CA 1.497 1.875 0 CA-C-O 121.927 0.87 . . . . 0.0 112.101 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.507 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 21.3 p . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -89.79 164.91 14.46 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.495 1.813 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.321 -179.948 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.994 0 CA-C-O 119.002 -0.888 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.62 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 23.4 m -63.46 140.85 58.91 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-N 117.818 0.809 . . . . 0.0 109.49 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.6 m -59.94 95.07 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.482 1.114 . . . . 0.0 113.544 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.486 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 42.9 t -150.38 154.47 37.83 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.003 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.0 m -145.01 54.85 1.22 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.054 -1.43 . . . . 0.0 108.83 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.57 ' H ' ' CB ' ' A' ' 19' ' ' CYS . 32.3 mmmt 68.94 42.36 1.32 Allowed 'General case' 0 N--CA 1.504 2.237 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.413 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 66.1 p -140.42 26.71 2.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 113.444 -1.707 . . . . 0.0 110.752 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.486 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 42.9 t -152.8 -52.53 0.11 Allowed 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 57.58 12.44 1.55 Allowed 'General case' 0 N--CA 1.503 2.183 0 O-C-N 124.505 1.128 . . . . 0.0 111.768 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -75.82 -42.12 50.72 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.323 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.62 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 87.6 m -49.29 144.55 5.23 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 115.999 1.851 . . . . 0.0 115.999 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.507 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 35.0 m -54.63 -42.79 71.66 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 112.44 -2.164 . . . . 0.0 110.861 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.428 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -89.79 -91.72 0.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.3 p -171.81 179.29 2.8 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.57 ' CB ' ' H ' ' A' ' 10' ' ' LYS . 80.1 m -96.09 115.75 27.91 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.957 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.408 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 . . . . . 0 N--CA 1.504 2.264 0 CA-C-O 122.129 0.966 . . . . 0.0 108.671 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -119.6 -9.01 9.88 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 112.873 -1.967 . . . . 0.0 107.624 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt 51.45 26.57 3.25 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.81 1.319 . . . . 0.0 108.321 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -133.54 177.99 7.27 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 103.864 -2.643 . . . . 0.0 103.864 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.2 m -95.39 153.46 17.68 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.759 0.79 . . . . 0.0 109.467 179.728 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.421 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 23.1 p . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 121.184 0.516 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -116.3 168.23 10.32 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.732 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.4 p . . . . . 0 N--CA 1.497 1.906 0 CA-C-N 114.448 -1.251 . . . . 0.0 112.31 179.984 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.965 0 CA-C-O 119.684 -0.509 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.5 t -69.02 152.82 44.77 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.3 m -74.29 104.42 5.05 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 117.866 2.543 . . . . 0.0 117.866 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.626 ' SG ' ' N ' ' A' ' 12' ' ' SER . 2.2 t -88.9 137.94 31.86 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.6 t -77.74 78.53 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.9 tttp 63.53 -70.14 0.07 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 113.046 -1.888 . . . . 0.0 110.656 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.1 p -125.32 27.9 6.46 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 123.327 0.392 . . . . 0.0 111.923 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.626 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 90.2 p -68.45 107.17 2.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -74.47 82.54 1.96 Allowed 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.9 p30 -147.09 5.57 0.85 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 112.754 -2.021 . . . . 0.0 109.882 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 72.9 m -95.35 128.25 42.05 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.292 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.421 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.5 m -55.09 -30.66 60.14 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.5 mmm-85 -90.58 -94.08 0.12 Allowed 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 104.821 -2.289 . . . . 0.0 104.821 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 p -177.83 176.09 1.24 Allowed 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.484 ' SG ' ' O ' ' A' ' 12' ' ' SER . 75.3 m -90.66 106.32 18.42 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 116.16 1.911 . . . . 0.0 116.16 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.488 HD22 ' H ' ' A' ' 23' ' ' THR . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.807 0 N-CA-C 106.341 -1.725 . . . . 0.0 106.341 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.44 ' HB2' HD21 ' A' ' 20' ' ' ASN . 50.0 m-85 . . . . . 0 N--CA 1.503 2.21 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.488 ' H ' HD22 ' A' ' 20' ' ' ASN . 41.4 p -121.25 5.72 10.24 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 112.872 -1.967 . . . . 0.0 109.122 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.13 30.93 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.472 0 O-C-N 125.34 1.65 . . . . 0.0 113.117 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.45 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 15.2 ptm180 -127.32 -168.02 1.82 Allowed 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 112.042 -2.345 . . . . 0.0 105.539 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.5 m -95.34 152.39 18.42 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.614 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 122.195 0.998 . . . . 0.0 111.236 179.508 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.172 0.51 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -84.93 160.25 20.15 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.955 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.0 m . . . . . 0 N--CA 1.496 1.826 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.437 -179.918 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.869 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.3 m -78.76 135.93 37.25 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.9 t -55.18 91.79 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 124.532 1.145 . . . . 0.0 113.609 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.1 -169.46 2.26 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.092 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.0 m -143.22 -50.71 0.34 Allowed 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.019 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.475 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 5.6 ttpm? -167.55 -47.76 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.968 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 t -89.61 68.04 7.6 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.149 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -88.77 39.46 0.92 Allowed 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 114.496 -1.229 . . . . 0.0 113.743 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -62.06 -24.09 66.88 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -57.82 -43.4 85.71 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 114.259 -1.337 . . . . 0.0 108.858 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.5 m -83.75 138.12 33.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 124.526 1.141 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.21 -22.14 65.69 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 123.776 0.672 . . . . 0.0 110.883 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -89.44 -111.81 0.07 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 124.075 0.859 . . . . 0.0 108.814 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.9 p -163.79 -156.35 0.35 Allowed 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 117.751 -1.118 . . . . 0.0 109.173 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.5 t -117.19 109.89 17.47 Favored 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 . . . . . 0 N--CA 1.494 1.77 0 CA-C-N 114.902 -1.044 . . . . 0.0 108.241 179.696 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 . . . . . 0 N--CA 1.502 2.168 0 CA-C-O 122.053 0.93 . . . . 0.0 109.008 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.401 ' OG1' ' HG2' ' A' ' 25' ' ' ARG . 41.4 p -139.1 -9.29 1.31 Allowed 'General case' 0 N--CA 1.492 1.636 0 CA-C-N 113.016 -1.902 . . . . 0.0 108.896 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 7.0 mtpm? 49.34 29.21 2.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.771 1.294 . . . . 0.0 108.469 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.401 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 5.6 ptp180 -130.33 170.22 14.43 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -77.0 152.83 35.03 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 N--CA 1.492 1.647 0 C-N-CA 119.767 -0.773 . . . . 0.0 109.312 179.597 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.545 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 2.5 mppt? -92.32 157.55 16.58 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 54.0 m . . . . . 0 N--CA 1.502 2.126 0 O-C-N 123.23 0.331 . . . . 0.0 111.433 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.928 0 N-CA-C 108.706 -1.758 . . . . 0.0 108.706 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.1 m -65.99 143.35 57.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.8 t -50.64 96.41 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 O-C-N 125.355 1.66 . . . . 0.0 114.455 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 47.9 t -140.71 149.42 42.17 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.588 0.709 . . . . 0.0 111.494 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.1 m -151.8 -65.03 0.18 Allowed 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.472 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 3.8 mmmp? -148.43 19.75 1.06 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 124.847 1.342 . . . . 0.0 109.061 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -114.87 -63.18 1.49 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 123.648 0.593 . . . . 0.0 111.635 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 49.3 m -62.95 143.56 57.61 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 123.915 0.759 . . . . 0.0 109.161 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.411 ' HB2' ' HZ2' ' A' ' 2' ' ' LYS . 97.4 m-85 -67.42 21.98 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.8 m120 68.17 115.51 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.35 1.071 . . . . 0.0 113.887 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 2' ' ' LYS . 72.2 m -57.54 170.49 0.54 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.312 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 99.0 m -53.22 -20.89 4.5 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.587 -0.445 . . . . 0.0 112.026 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -89.52 -76.22 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.6 p 175.19 178.4 0.15 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 124.641 1.213 . . . . 0.0 109.612 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -104.91 120.56 41.73 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.516 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.259 0 O-C-N 123.957 0.786 . . . . 0.0 109.74 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 50.8 p90 . . . . . 0 N--CA 1.504 2.237 0 CA-C-O 121.791 0.805 . . . . 0.0 112.23 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.3 m -136.16 -11.58 1.94 Allowed 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 106.252 -1.759 . . . . 0.0 106.252 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm 53.29 31.86 12.53 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.417 ' HA ' ' H ' ' A' ' 8' ' ' CYS . 81.4 mtt85 -148.84 178.05 9.0 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.808 -1.996 . . . . 0.0 110.478 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 62.0 m -95.94 -178.49 4.37 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 20' ' ' ASN . 73.3 m-85 . . . . . 0 N--CA 1.489 1.486 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.548 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.457 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 17.1 p . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 121.276 0.56 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 2' ' ' LYS . 1.8 mppt? -94.9 165.41 12.47 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.602 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p . . . . . 0 N--CA 1.496 1.833 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.542 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.507 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.488 2.14 0 CA-C-O 119.576 -0.569 . . . . 0.0 113.564 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.468 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 32.0 t -64.94 133.29 51.46 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 77.7 p -63.84 84.51 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 23.0 p -126.83 123.95 38.51 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.367 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.5 p -34.44 -101.53 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 118.423 2.749 . . . . 0.0 118.423 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.438 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 0.2 OUTLIER -148.07 -34.42 0.23 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 118.396 0.544 . . . . 0.0 111.827 -179.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -89.58 -10.33 46.47 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.47 1.106 . . . . 0.0 110.463 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.1 m -59.21 -65.26 0.7 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.538 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.426 ' N ' ' SG ' ' A' ' 19' ' ' CYS . 36.3 m-85 55.2 19.39 2.87 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 124.064 0.852 . . . . 0.0 110.182 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -58.87 -34.88 72.12 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 92.0 m -69.23 151.01 46.81 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.457 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 46.9 m -44.17 -39.55 4.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 125.557 1.786 . . . . 0.0 108.686 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.421 ' HE ' ' HB3' ' A' ' 27' ' ' TYR . 54.1 ttt85 -89.81 -94.15 0.11 Allowed 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 105.569 -2.012 . . . . 0.0 105.569 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.7 p -171.26 176.36 3.93 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 119.391 0.996 . . . . 0.0 112.691 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 80.5 m -106.22 112.15 25.06 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 123.939 0.775 . . . . 0.0 113.066 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.508 HD22 HG21 ' A' ' 23' ' ' THR . 60.6 t30 . . . . . 0 N--CA 1.496 1.843 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.095 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.9 p90 . . . . . 0 N--CA 1.506 2.361 0 CA-C-O 123.035 1.398 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.508 HG21 HD22 ' A' ' 20' ' ' ASN . 7.8 t -150.9 -13.04 0.22 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 111.653 -2.522 . . . . 0.0 106.471 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? 38.79 41.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 125.241 1.588 . . . . 0.0 110.958 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.483 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.2 ptm180 -139.2 164.22 30.38 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 102.978 -2.971 . . . . 0.0 102.978 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 89.4 m -75.7 165.4 25.11 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 118.51 -1.276 . . . . 0.0 113.183 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.421 ' HB3' ' HE ' ' A' ' 17' ' ' ARG . 80.2 m-85 . . . . . 0 N--CA 1.488 1.443 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.181 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.0 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.475 0.655 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.467 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 11.8 mptt -89.18 179.85 6.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.967 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.6 p . . . . . 0 N--CA 1.496 1.851 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.633 -179.967 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.409 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 67.5 m -64.12 133.3 52.72 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.6 p -58.31 89.04 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 O-C-N 124.947 1.404 . . . . 0.0 114.309 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 38.1 t -89.38 145.74 25.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.828 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.1 p -100.45 46.86 0.94 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp 65.56 -2.37 0.85 Allowed 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.945 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.8 p -143.32 80.46 1.67 Allowed 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.651 0.738 . . . . 0.0 110.805 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.535 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 39.4 t -159.54 82.91 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -76.17 5.17 7.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 114.044 -1.435 . . . . 0.0 110.67 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.505 ' H ' HD22 ' A' ' 14' ' ' ASN . 6.6 m-80 -55.3 -39.52 70.0 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.372 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 76.2 m -71.14 150.79 45.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.788 0.68 . . . . 0.0 109.904 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 94.3 m -58.56 -35.98 73.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 123.684 0.615 . . . . 0.0 112.142 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -89.73 -101.68 0.1 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 117.808 -1.091 . . . . 0.0 111.523 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.9 p -166.37 -171.73 2.01 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 119.636 1.107 . . . . 0.0 112.152 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 88.7 m -96.39 114.43 26.1 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.477 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 49.5 p90 . . . . . 0 N--CA 1.501 2.102 0 CA-C-O 122.35 1.071 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' LYS . 59.1 m -143.71 -7.81 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' THR . 24.1 pttm 37.71 34.32 0.05 Allowed 'General case' 0 N--CA 1.507 2.396 0 CA-C-O 122.811 1.291 . . . . 0.0 111.563 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.2 mtt85 -142.31 170.86 14.91 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 111.391 -2.64 . . . . 0.0 108.694 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.5 m -84.89 157.76 20.79 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.36 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 . . . . . 0 N--CA 1.49 1.552 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.58 179.438 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.7 p . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.397 0.618 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -84.53 177.64 8.02 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.57 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.494 1.726 0 CA-C-N 115.032 -0.985 . . . . 0.0 113.079 -179.78 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.4 t -56.67 144.51 32.03 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.4 m -66.12 86.09 0.1 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.433 ' SG ' ' OG ' ' A' ' 12' ' ' SER . 37.3 t -89.85 120.14 30.83 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.668 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.7 t -124.02 63.18 1.07 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt 79.66 -49.03 0.38 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-N 112.939 -1.937 . . . . 0.0 109.925 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 70.0 p -89.59 107.97 19.39 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 123.848 0.718 . . . . 0.0 110.992 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.433 ' OG ' ' SG ' ' A' ' 8' ' ' CYS . 89.6 p -169.19 3.94 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.605 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.408 ' H ' ' H ' ' A' ' 12' ' ' SER . 88.7 m-85 56.35 22.0 5.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 123.685 0.616 . . . . 0.0 111.083 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 42.6 t30 63.01 106.21 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.153 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.3 m -59.5 166.17 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.959 -1.473 . . . . 0.0 109.52 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.0 m -36.19 -43.63 0.36 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 124.234 0.959 . . . . 0.0 112.362 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 17' ' ' ARG . 55.5 mtt-85 -101.83 -96.78 0.28 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 107.543 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -168.7 147.28 4.13 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 75.7 m -66.8 143.64 56.78 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.916 -1.947 . . . . 0.0 113.506 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.406 ' HB2' ' CE1' ' A' ' 27' ' ' TYR . 49.7 t30 . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 . . . . . 0 N--CA 1.499 1.988 0 N-CA-C 103.995 -2.594 . . . . 0.0 103.995 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.7 p -90.01 -10.18 45.86 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.445 -1.707 . . . . 0.0 107.52 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 51.97 33.58 12.05 Favored 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -141.11 152.01 44.41 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 110.742 -2.935 . . . . 0.0 109.464 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 95.6 m -83.47 -178.27 7.0 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.615 0.722 . . . . 0.0 110.108 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 20' ' ' ASN . 19.6 m-85 . . . . . 0 C--N 1.303 -1.438 0 CA-C-N 114.087 -1.415 . . . . 0.0 107.606 179.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.491 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 14.2 p . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 121.02 0.438 . . . . 0.0 112.176 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.452 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 10.1 mtmp? -83.69 -179.08 7.22 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.188 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 N--CA 1.495 1.816 0 CA-C-N 115.019 -0.991 . . . . 0.0 112.28 -179.902 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.486 2.002 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.457 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 61.3 m -64.08 134.04 54.17 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 51.6 m -60.6 90.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 124.696 1.247 . . . . 0.0 114.161 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 28.3 p -149.33 168.28 23.8 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.246 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -169.77 164.02 9.89 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 113.909 -1.496 . . . . 0.0 110.531 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp 48.99 -99.65 0.06 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -89.34 78.72 7.17 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.98 0.895 . . . . 0.0 109.649 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.443 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 59.4 m -155.05 116.11 3.97 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -135.45 84.56 2.1 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -140.1 -48.75 0.45 Allowed 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.779 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 92.9 m -57.51 141.66 46.96 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.491 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.3 m -46.46 -33.7 4.19 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 113.006 -1.906 . . . . 0.0 110.634 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -99.26 -93.34 0.26 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.0 p -174.59 -178.19 1.3 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 76.7 m -98.8 109.28 22.06 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.596 HD22 ' H ' ' A' ' 23' ' ' THR . 6.6 t30 . . . . . 0 N--CA 1.499 1.998 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.613 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.459 ' HB2' HD21 ' A' ' 20' ' ' ASN . 72.3 m-85 . . . . . 0 N--CA 1.502 2.146 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.596 ' H ' HD22 ' A' ' 20' ' ' ASN . 74.7 p -90.99 -9.72 44.96 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.835 -1.53 . . . . 0.0 107.556 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 54.69 28.45 10.11 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -139.05 166.52 24.28 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 111.253 -2.703 . . . . 0.0 108.501 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 90.4 m -79.23 154.76 28.96 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 . . . . . 0 N--CA 1.49 1.543 0 CA-C-N 113.442 -1.708 . . . . 0.0 110.566 179.889 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.569 0.699 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.08 147.44 23.72 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 113.655 -1.611 . . . . 0.0 107.775 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 57.5 m . . . . . 0 N--CA 1.498 1.932 0 O-C-N 124.293 0.996 . . . . 0.0 112.359 -179.909 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 CA-C-O 119.438 -0.646 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.488 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 33.1 t -65.06 140.13 58.8 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.2 m -63.59 91.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -106.71 126.24 52.03 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.41 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.5 m -140.71 84.86 1.96 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 124.158 0.911 . . . . 0.0 110.932 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? 52.8 25.94 4.2 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.411 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -145.66 -43.49 0.21 Allowed 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 m -85.0 57.55 4.51 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -80.38 80.64 6.79 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.478 1.133 . . . . 0.0 108.207 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 p30 -162.3 15.34 0.08 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.889 -1.959 . . . . 0.0 109.87 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 81.9 m -65.23 126.31 27.77 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.1 m -45.0 -39.69 5.81 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -94.66 -83.33 0.35 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.7 p -176.62 170.62 2.41 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.813 0.696 . . . . 0.0 110.838 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 87.3 m -94.24 112.67 24.49 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.526 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.882 0 CA-C-N 114.539 -1.209 . . . . 0.0 107.797 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.2 p90 . . . . . 0 N--CA 1.505 2.308 0 CA-C-O 122.704 1.24 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.0 p -150.11 -15.54 0.25 Allowed 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 112.368 -2.197 . . . . 0.0 107.59 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp 50.3 31.93 5.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 124.399 1.062 . . . . 0.0 109.261 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -136.43 173.38 11.77 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 73.7 m -89.32 149.12 23.18 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.972 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CE1' ' HA ' ' A' ' 20' ' ' ASN . 82.7 m-85 . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 121.983 0.897 . . . . 0.0 110.247 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 120.787 0.327 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -97.1 165.45 12.06 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.498 1.962 0 O-C-N 123.777 0.673 . . . . 0.0 110.843 179.959 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.449 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.486 2.0 0 N-CA-C 109.797 -1.321 . . . . 0.0 109.797 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 31.9 t -74.12 147.21 42.91 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.3 t -66.13 96.33 0.32 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 124.327 1.017 . . . . 0.0 108.972 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.6 p -89.62 165.44 14.24 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.388 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.8 m -66.64 -69.32 0.31 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.848 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -164.32 -39.84 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.852 0.72 . . . . 0.0 109.294 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -142.8 23.78 1.89 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.111 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.0 t -55.43 111.71 0.95 Allowed 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.455 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -69.59 -8.09 44.34 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.802 -1.545 . . . . 0.0 111.596 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -58.49 -32.85 69.17 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.834 0.709 . . . . 0.0 109.652 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.4 m -57.23 129.78 43.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 124.204 0.94 . . . . 0.0 111.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.7 m -51.3 -41.41 60.48 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' HA ' HH11 ' A' ' 17' ' ' ARG . 8.7 mmm180 -93.75 -80.81 0.38 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.785 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.466 ' HG ' ' HD2' ' A' ' 27' ' ' TYR . 33.0 p -174.11 176.13 2.59 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 123.973 0.796 . . . . 0.0 109.643 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.5 t -97.31 111.15 23.53 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -179.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.551 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 1.1 t-20 . . . . . 0 N--CA 1.498 1.968 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.637 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 . . . . . 0 N--CA 1.498 1.954 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.8 p -97.97 6.15 48.02 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 113.93 -1.486 . . . . 0.0 109.442 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.2 pttm 41.93 31.8 0.25 Allowed 'General case' 0 N--CA 1.51 2.562 0 CA-C-O 123.589 1.662 . . . . 0.0 110.007 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -136.42 -178.54 5.21 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 110.514 -3.039 . . . . 0.0 107.643 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.449 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 81.0 m -85.86 144.62 27.6 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.405 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.551 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 65.9 m-85 . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 121.912 0.863 . . . . 0.0 109.892 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.48 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 10.8 p . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -71.84 159.7 33.84 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.363 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.497 1.901 0 O-C-N 123.803 0.69 . . . . 0.0 111.415 -179.849 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.131 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.2 m -53.14 123.28 11.33 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.1 p -67.18 80.58 0.13 Allowed 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.709 1.256 . . . . 0.0 113.952 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 5.9 p -109.85 120.06 41.28 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.945 0.878 . . . . 0.0 112.783 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.0 m -112.54 100.94 9.13 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 112.585 -2.098 . . . . 0.0 108.341 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.512 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 10.5 mptt 58.48 7.99 0.79 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.156 0.91 . . . . 0.0 112.873 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.6 p -141.19 107.78 5.33 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 123.438 0.461 . . . . 0.0 110.055 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.529 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 41.5 t -157.31 140.98 15.86 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-N 115.077 -0.965 . . . . 0.0 108.476 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -81.25 -53.13 6.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.5 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.457 HD22 ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -178.45 77.47 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.2 m -68.4 145.39 54.17 Favored 'General case' 0 N--CA 1.5 2.07 0 C-N-CA 119.061 -1.056 . . . . 0.0 111.014 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.48 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.1 m -47.94 -28.57 2.78 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.995 1.434 . . . . 0.0 109.075 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.7 mmm-85 -116.47 -110.86 0.35 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 106.163 -1.792 . . . . 0.0 106.163 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.6 p -173.72 140.63 0.78 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.529 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 58.9 m -51.63 103.52 0.06 Allowed 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.5 t-20 . . . . . 0 N--CA 1.495 1.801 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 N--CA 1.499 2.014 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -132.31 2.74 3.9 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.001 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 pttm 40.95 33.4 0.21 Allowed 'General case' 0 N--CA 1.506 2.373 0 O-C-N 124.978 1.424 . . . . 0.0 109.632 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 20' ' ' ASN . 90.1 mtt-85 -138.36 139.7 39.12 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 111.284 -2.689 . . . . 0.0 108.969 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 67.1 m -65.42 144.17 57.24 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.737 1.256 . . . . 0.0 113.815 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 . . . . . 0 N--CA 1.492 1.628 0 CA-C-N 111.94 -2.391 . . . . 0.0 111.701 179.955 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.408 ' SG ' ' N ' ' A' ' 16' ' ' CYS . 69.2 m . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.553 ' HG3' ' H ' ' A' ' 3' ' ' SER . 52.7 tptt -107.51 -134.53 0.34 Allowed 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.553 ' H ' ' HG3' ' A' ' 2' ' ' LYS . 80.9 p . . . . . 0 N--CA 1.496 1.848 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.988 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.57 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 29.5 m -64.68 142.0 58.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.4 p -54.92 83.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 125.514 1.759 . . . . 0.0 115.624 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.5 t -143.57 132.7 23.04 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.146 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 41.2 t -79.97 -71.96 0.43 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 114.075 -1.421 . . . . 0.0 113.457 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 10' ' ' LYS . 4.8 ttmp? -118.91 -46.3 2.54 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.7 t -151.01 125.12 9.3 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.1 m -138.99 -8.78 1.35 Allowed 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 112.903 -1.953 . . . . 0.0 108.823 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 60.74 5.93 1.04 Allowed 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 114.479 1.289 . . . . 0.0 114.479 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -82.11 -77.83 0.22 Allowed 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.11 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 71.3 m -44.34 130.11 6.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.408 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 90.3 m -66.12 -15.58 63.23 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.461 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 2.9 mmp_? -90.01 -110.94 0.08 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 61.5 p -161.19 171.53 18.3 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.1 m -100.18 122.29 42.79 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -179.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.494 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.908 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.0 p90 . . . . . 0 N--CA 1.502 2.168 0 CA-C-O 122.678 1.228 . . . . 0.0 111.425 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.2 p -148.7 -9.56 0.35 Allowed 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 112.26 -2.245 . . . . 0.0 105.696 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 40.46 32.51 0.14 Allowed 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 123.398 1.57 . . . . 0.0 112.137 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -132.64 164.97 25.53 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 110.282 -3.145 . . . . 0.0 106.663 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.0 m -85.95 161.5 18.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.349 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 N--CA 1.49 1.534 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.823 179.646 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.405 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 26.8 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -87.67 162.79 16.9 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.5 p . . . . . 0 N--CA 1.495 1.82 0 O-C-N 124.007 0.817 . . . . 0.0 112.928 -179.872 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.949 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.523 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 38.5 m -44.6 135.18 5.0 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.8 p -64.22 90.43 0.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 124.579 1.174 . . . . 0.0 113.203 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.7 p -100.69 -155.12 0.5 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.445 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.8 p -154.02 -50.92 0.09 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.037 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -167.37 -35.26 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 124.018 0.824 . . . . 0.0 109.843 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.3 m -115.17 94.14 4.6 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.146 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.8 t -158.65 61.88 0.43 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.036 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -66.6 -15.05 63.16 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.987 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -58.3 -31.49 67.55 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 124.206 0.942 . . . . 0.0 111.568 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 67.5 m -62.07 130.21 44.46 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.479 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.405 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 60.8 m -39.79 -43.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 125.246 1.591 . . . . 0.0 113.022 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -98.21 -82.69 0.42 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 123.987 0.804 . . . . 0.0 109.32 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.2 p -172.1 168.38 5.82 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 123.485 0.49 . . . . 0.0 110.866 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -91.25 135.76 33.57 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 . . . . . 0 N--CA 1.498 1.94 0 O-C-N 124.902 1.376 . . . . 0.0 108.903 179.798 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.5 p -115.65 -1.93 12.59 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.588 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm 54.07 28.92 9.44 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.48 168.35 19.64 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 104.691 -2.337 . . . . 0.0 104.691 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.2 m -93.03 150.23 20.67 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.478 -0.889 . . . . 0.0 113.019 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 . . . . . 0 N--CA 1.488 1.443 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.51 179.873 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.523 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 9.8 p . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -89.6 172.91 8.62 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-N 114.389 -1.278 . . . . 0.0 109.908 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 82.6 p . . . . . 0 N--CA 1.497 1.897 0 CA-C-N 114.669 -1.15 . . . . 0.0 112.394 179.865 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.425 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.479 1.506 0 CA-C-O 118.358 -1.246 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -57.17 135.81 56.41 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 118.399 1.1 . . . . 0.0 108.123 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 42.4 t -70.87 84.85 0.67 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 124.611 1.194 . . . . 0.0 110.564 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 8.3 p -115.29 142.09 47.14 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -93.69 -172.05 2.77 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 111.988 -2.369 . . . . 0.0 110.169 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 10' ' ' LYS . 2.1 mppt? -63.56 -19.86 65.16 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -89.82 17.62 6.47 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 123.397 0.436 . . . . 0.0 110.817 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.451 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 45.0 t -158.62 134.23 8.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.696 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.47 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 69.5 m-85 -145.09 27.25 1.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 CA-C-N 113.816 -1.538 . . . . 0.0 107.087 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -54.23 -28.13 39.25 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-N 114.048 -1.433 . . . . 0.0 114.393 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -65.59 155.69 35.02 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.523 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 36.2 m -52.85 -39.85 62.89 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 112.374 -2.194 . . . . 0.0 111.417 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.47 ' N ' ' HD2' ' A' ' 17' ' ' ARG . 2.2 mpt_? -92.54 -89.01 0.2 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.1 p -173.62 -172.99 0.82 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.47 ' SG ' ' HA ' ' A' ' 13' ' ' TYR . 73.9 m -108.72 104.27 13.53 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.495 1.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 109.304 179.674 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 . . . . . 0 N--CA 1.498 1.97 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.2 p -91.84 -7.72 48.58 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.686 -1.597 . . . . 0.0 108.731 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 6.8 mtpm? 54.26 27.05 7.4 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -133.96 167.63 20.26 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 111.888 -2.415 . . . . 0.0 110.073 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 93.7 m -82.9 154.32 24.65 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.494 1.14 . . . . 0.0 113.852 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 . . . . . 0 C--N 1.303 -1.455 0 CA-C-N 112.513 -2.13 . . . . 0.0 108.736 179.756 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -99.43 163.12 12.65 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.108 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 N--CA 1.496 1.848 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.771 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.416 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . . . . . . 0 N--CA 1.484 1.862 0 CA-C-O 119.251 -0.749 . . . . 0.0 111.66 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.6 t -66.18 152.41 44.88 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -67.28 88.21 0.18 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 124.285 0.99 . . . . 0.0 111.499 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -93.4 148.65 21.87 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.42 -1.264 . . . . 0.0 111.132 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.6 t -83.09 169.61 15.69 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -53.14 -51.78 60.83 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.602 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.4 t -97.93 59.12 1.41 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.365 1.041 . . . . 0.0 112.883 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.7 p -159.4 85.01 0.78 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.194 0.997 . . . . 0.0 109.647 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -94.38 52.3 1.55 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.227 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.502 ' H ' HD22 ' A' ' 14' ' ' ASN . 3.9 m-80 -64.54 -35.86 82.32 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.065 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 77.1 m -66.08 146.68 54.39 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 124.13 0.894 . . . . 0.0 110.644 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.3 m -58.17 -18.45 25.78 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 123.738 0.649 . . . . 0.0 111.284 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.0 mmm-85 -89.46 -95.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.8 p -174.13 -172.49 0.71 Allowed 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 41.9 t -119.86 120.83 37.61 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 . . . . . 0 N--CA 1.493 1.72 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 179.875 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 . . . . . 0 N--CA 1.501 2.108 0 N-CA-C 104.337 -2.468 . . . . 0.0 104.337 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.419 HG23 ' H ' ' A' ' 25' ' ' ARG . 4.7 t -89.71 -4.86 57.52 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 112.771 -2.013 . . . . 0.0 107.812 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm 51.18 29.81 5.14 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 122.46 1.124 . . . . 0.0 108.733 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.419 ' H ' HG23 ' A' ' 23' ' ' THR . 52.6 mtp180 -135.59 157.41 46.95 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 111.839 -2.437 . . . . 0.0 110.025 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.416 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 95.4 m -74.66 163.97 27.11 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.83 0.824 . . . . 0.0 112.369 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 . . . . . 0 N--CA 1.488 1.445 0 CA-C-N 113.708 -1.587 . . . . 0.0 109.82 179.765 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.6 p . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -134.5 -177.11 4.46 Favored 'General case' 0 N--CA 1.494 1.737 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 5' ' ' GLY . 50.0 m -63.77 159.65 18.94 Favored 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.604 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.414 ' H ' ' H ' ' A' ' 6' ' ' SER . . . -178.9 10.61 0.03 OUTLIER Glycine 0 N--CA 1.485 1.918 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.225 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.414 ' H ' ' H ' ' A' ' 5' ' ' GLY . 33.4 t -64.96 138.16 58.19 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.5 m -65.32 91.14 0.11 Allowed 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.381 1.05 . . . . 0.0 113.015 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.5 p -89.6 -152.69 0.25 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 114.203 -1.362 . . . . 0.0 107.542 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.8 t -162.16 -120.0 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.435 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -110.32 -42.23 4.19 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.8 p -89.76 -21.13 22.8 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.273 0.983 . . . . 0.0 111.706 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.4 t -72.56 94.96 1.76 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 123.741 0.651 . . . . 0.0 110.583 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -103.42 21.84 15.28 Favored 'General case' 0 N--CA 1.499 2.023 0 CA-C-N 114.603 -1.18 . . . . 0.0 108.654 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -77.94 21.11 0.33 Allowed 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.325 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.8 m -96.15 125.82 40.94 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 118.121 -0.943 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.6 m -63.05 -29.54 70.9 Favored 'General case' 0 N--CA 1.501 2.109 0 CA-C-N 119.532 1.06 . . . . 0.0 108.213 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.6 tpt85 -89.35 -85.53 0.2 Allowed 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.1 p -174.66 167.62 3.77 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 123.836 0.71 . . . . 0.0 109.489 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.2 t -102.42 117.38 34.61 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 114.403 1.261 . . . . 0.0 114.403 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.448 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 46.2 t30 -89.6 111.22 22.1 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 124.433 1.083 . . . . 0.0 108.621 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -89.44 -34.59 16.4 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.4 p -108.87 -4.1 17.1 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 113.668 -1.605 . . . . 0.0 109.872 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm 53.78 26.2 5.81 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -132.89 161.04 35.27 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 112.506 -2.133 . . . . 0.0 109.893 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 85.8 m -75.35 141.92 43.25 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 123.659 0.6 . . . . 0.0 112.147 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 80.9 m-85 -59.45 149.58 29.09 Favored 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 121.983 0.897 . . . . 0.0 109.749 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.462 0 O-C-N 119.49 -2.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.436 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 24.4 p . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 121.223 0.535 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' NZ ' ' HB3' ' A' ' 2' ' ' LYS . 3.3 mmmp? -107.56 -177.43 3.35 Favored 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.624 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.2 p -60.28 161.05 7.6 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 123.448 0.468 . . . . 0.0 111.245 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . 0.409 ' HB2' ' HD3' ' A' ' 17' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.499 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 179.73 8.67 0.02 OUTLIER Glycine 0 N--CA 1.479 1.516 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.627 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.488 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 69.9 m -67.96 136.57 54.14 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 120.925 0.393 . . . . 0.0 111.656 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.461 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 49.2 m -57.25 93.89 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 27.4 p -142.75 127.8 18.5 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.4 t -59.85 171.75 0.87 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.836 -1.529 . . . . 0.0 114.381 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.439 ' HG2' ' HB2' ' A' ' 21' ' ' HYP . 5.6 tmtt? -41.22 -66.16 0.36 Allowed 'General case' 0 N--CA 1.501 2.084 0 CA-C-N 114.063 -1.426 . . . . 0.0 108.595 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 68.5 p -90.04 65.79 6.62 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.084 0.865 . . . . 0.0 111.791 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 m -143.19 25.92 1.69 Allowed 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 114.542 -1.208 . . . . 0.0 107.803 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -55.62 94.59 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 114.859 -1.064 . . . . 0.0 113.619 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -147.26 0.17 0.7 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.815 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.761 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 45.5 m -72.6 168.07 19.39 Favored 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.982 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.436 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 60.7 m -64.2 -29.62 70.72 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.409 ' HD3' ' HB2' ' A' ' 4' ' ' HYP . 74.6 mtp85 -108.65 -83.75 0.55 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 113.39 -1.732 . . . . 0.0 106.931 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.458 ' OG ' ' CD1' ' A' ' 27' ' ' TYR . 33.1 p -175.63 -175.18 0.75 Allowed 'General case' 0 N--CA 1.501 2.108 0 O-C-N 123.965 0.79 . . . . 0.0 108.915 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 98.8 m -106.97 100.52 10.01 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -48.61 111.33 0.45 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 112.249 -2.251 . . . . 0.0 108.934 179.698 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . 0.439 ' HB2' ' HG2' ' A' ' 10' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -89.11 12.71 14.95 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 124.352 1.033 . . . . 0.0 112.356 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 31.3 m -144.05 -7.62 0.72 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt 47.66 36.8 5.92 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.271 0.982 . . . . 0.0 108.931 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HG3' ' N ' ' A' ' 26' ' ' CYS . 10.2 ptt-85 -128.79 -174.68 3.32 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 103.705 -2.702 . . . . 0.0 103.705 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.558 ' N ' ' HG3' ' A' ' 25' ' ' ARG . 97.3 m -91.32 140.72 29.51 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 118.941 0.791 . . . . 0.0 109.211 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.458 ' CD1' ' OG ' ' A' ' 18' ' ' SER . 19.6 m-85 -50.58 134.43 24.25 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 121.63 0.729 . . . . 0.0 110.299 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.44 0 O-C-N 119.17 -2.206 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.461 ' SG ' ' N ' ' A' ' 2' ' ' LYS . 29.3 p . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.461 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 34.8 mmtp -143.32 175.45 9.89 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.8 p -65.53 153.6 41.02 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.506 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 155.03 5.68 0.09 OUTLIER Glycine 0 N--CA 1.483 1.786 0 CA-C-N 113.715 -1.584 . . . . 0.0 111.604 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.493 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 32.9 t -65.35 145.28 56.38 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.2 p -72.31 103.55 3.44 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 18.7 t -122.74 147.88 45.98 Favored 'General case' 0 N--CA 1.497 1.923 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.184 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.9 m -98.21 -76.29 0.53 Allowed 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.319 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -143.4 -54.66 0.38 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 124.222 0.951 . . . . 0.0 111.037 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -89.43 -5.31 57.5 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.618 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 59.2 m -75.64 87.48 2.72 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -72.1 18.84 0.08 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-N 114.36 -1.291 . . . . 0.0 113.15 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.426 ' H ' ' C ' ' A' ' 12' ' ' SER . 9.1 m-80 -69.43 -2.64 11.6 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.064 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 62.8 m -96.83 115.88 28.2 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 22.3 m -69.48 -23.92 63.71 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 118.708 -1.197 . . . . 0.0 108.559 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -89.24 -83.69 0.23 Allowed 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.1 p -175.37 168.14 3.3 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 123.896 0.747 . . . . 0.0 109.942 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 73.1 m -95.81 116.4 28.85 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.454 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -94.99 111.17 22.99 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . 0.444 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -89.57 23.96 2.45 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-O 122.25 1.024 . . . . 0.0 110.639 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 21' ' ' HYP . 54.6 m -150.11 -20.96 0.25 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.929 -1.941 . . . . 0.0 106.989 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 49.75 41.51 22.23 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 124.363 1.039 . . . . 0.0 108.497 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -147.59 163.41 36.69 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.506 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 62.1 m -84.83 144.65 28.3 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.46 -0.896 . . . . 0.0 109.346 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -58.89 150.09 25.16 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.928 0.87 . . . . 0.0 110.869 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.421 0 O-C-N 119.586 -1.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 77.8 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 110.629 -0.137 . . . . 0.0 110.629 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.581 ' HD3' ' H ' ' A' ' 3' ' ' SER . 1.8 tmtm? -104.48 146.34 29.01 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.581 ' H ' ' HD3' ' A' ' 2' ' ' LYS . 49.2 m -44.49 144.37 1.08 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 123.674 0.608 . . . . 0.0 111.606 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 162.87 21.67 0.02 OUTLIER Glycine 0 N--CA 1.486 2.025 0 CA-C-N 113.933 -1.485 . . . . 0.0 110.94 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.413 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 49.6 m -81.93 152.28 26.85 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 54.9 m -63.85 98.48 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.519 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 42.5 t -89.45 103.89 16.49 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 113.448 -1.706 . . . . 0.0 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.2 m -80.86 -152.32 0.09 Allowed 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 115.135 -0.939 . . . . 0.0 108.487 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.454 ' H ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -58.16 -22.2 50.35 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.903 179.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 52.4 p -97.71 149.24 22.51 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 m -136.3 9.19 3.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 123.665 0.603 . . . . 0.0 110.807 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -62.37 -17.55 59.29 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.179 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -65.76 -55.72 15.78 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.144 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 75.4 m -95.36 140.42 30.26 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.081 0.863 . . . . 0.0 112.405 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 96.1 m -66.98 -11.73 57.68 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 34.9 mmt180 -89.59 -121.99 0.06 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 p -164.49 -174.89 3.63 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 98.9 m -81.33 109.5 15.89 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 117.705 2.483 . . . . 0.0 117.705 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.497 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -90.54 106.48 18.53 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 179.382 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -88.91 25.14 1.86 Allowed 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 122.206 1.003 . . . . 0.0 111.892 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.447 ' H ' ' H ' ' A' ' 24' ' ' LYS . 70.4 p -150.14 -17.33 0.25 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-N 113.036 -1.893 . . . . 0.0 107.919 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.447 ' H ' ' H ' ' A' ' 23' ' ' THR . 59.9 mttp 56.44 33.19 22.04 Favored 'General case' 0 N--CA 1.505 2.301 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 48.3 mtp180 -140.74 178.67 7.18 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 111.548 -2.569 . . . . 0.0 108.581 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.519 ' SG ' ' HB2' ' A' ' 8' ' ' CYS . 74.1 m -85.49 167.17 15.7 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.404 ' CZ ' ' HA ' ' A' ' 20' ' ' ASN . 69.2 m-85 -74.93 85.03 2.24 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 122.33 1.062 . . . . 0.0 110.863 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.424 0 O-C-N 119.581 -1.95 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.573 0.701 . . . . 0.0 112.111 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -100.95 153.89 19.14 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.789 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 47.3 t -57.24 146.57 27.96 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 124.07 0.856 . . . . 0.0 109.921 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.535 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 84.75 8.18 83.12 Favored Glycine 0 N--CA 1.486 1.99 0 O-C-N 125.02 1.45 . . . . 0.0 111.695 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.505 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 34.2 t -70.18 133.38 47.03 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 38.2 t -68.8 109.1 3.7 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 20.9 p -148.9 149.3 31.02 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 114.761 -1.109 . . . . 0.0 113.267 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 80.3 p -62.48 176.01 0.7 Allowed 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 113.553 -1.658 . . . . 0.0 113.793 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.99 -36.49 49.94 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 72.1 p -88.62 -139.31 0.12 Allowed 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.415 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 46.3 t 49.97 73.59 0.25 Allowed 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.521 0.677 . . . . 0.0 109.37 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -81.88 40.51 0.61 Allowed 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.422 -179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -91.59 7.75 39.97 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 114.037 -1.438 . . . . 0.0 109.995 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.779 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 69.6 m -90.87 134.92 34.08 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 123.571 0.544 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 64.2 m -57.62 -28.19 63.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 -103.82 -85.53 0.46 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 36.3 p 179.28 166.32 1.02 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.659 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 79.5 m -91.68 113.62 25.94 Favored 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.518 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -88.2 123.92 33.31 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 114.548 -1.206 . . . . 0.0 108.547 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . 0.462 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -88.91 23.92 2.22 Favored 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 122.44 1.114 . . . . 0.0 112.537 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.415 ' CG2' ' HB3' ' A' ' 20' ' ' ASN . 8.4 t -150.72 -16.33 0.23 Allowed 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 113.002 -1.908 . . . . 0.0 107.671 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' THR . 31.2 mmmt 50.31 44.53 26.5 Favored 'General case' 0 N--CA 1.502 2.164 0 CA-C-O 122.727 1.251 . . . . 0.0 107.701 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 92.0 mtt-85 -150.14 158.1 43.81 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 110.963 -2.835 . . . . 0.0 108.559 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.535 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 74.1 m -76.3 138.03 40.26 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.751 -0.779 . . . . 0.0 110.434 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 20' ' ' ASN . 84.1 m-85 -46.15 141.65 3.22 Favored 'General case' 0 N--CA 1.497 1.875 0 CA-C-O 121.927 0.87 . . . . 0.0 112.101 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.384 0 O-C-N 119.532 -1.98 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.507 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 21.3 p . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -89.79 164.91 14.46 Favored 'General case' 0 N--CA 1.497 1.904 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 77.9 p -51.9 147.93 6.45 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.321 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.494 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 139.69 7.35 1.03 Allowed Glycine 0 N--CA 1.486 1.994 0 O-C-N 125.321 1.638 . . . . 0.0 111.755 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.62 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 23.4 m -63.46 140.85 58.91 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-N 117.818 0.809 . . . . 0.0 109.49 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.6 m -59.94 95.07 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.482 1.114 . . . . 0.0 113.544 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.486 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 42.9 t -150.38 154.47 37.83 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.003 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.0 m -145.01 54.85 1.22 Allowed 'General case' 0 N--CA 1.498 1.952 0 CA-C-N 114.054 -1.43 . . . . 0.0 108.83 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.57 ' H ' ' CB ' ' A' ' 19' ' ' CYS . 32.3 mmmt 68.94 42.36 1.32 Allowed 'General case' 0 N--CA 1.504 2.237 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.413 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 66.1 p -140.42 26.71 2.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 113.444 -1.707 . . . . 0.0 110.752 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.486 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 42.9 t -152.8 -52.53 0.11 Allowed 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 57.58 12.44 1.55 Allowed 'General case' 0 N--CA 1.503 2.183 0 O-C-N 124.505 1.128 . . . . 0.0 111.768 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -75.82 -42.12 50.72 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.323 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.62 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 87.6 m -49.29 144.55 5.23 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 115.999 1.851 . . . . 0.0 115.999 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.507 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 35.0 m -54.63 -42.79 71.66 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 112.44 -2.164 . . . . 0.0 110.861 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.428 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 4.2 mmp_? -89.79 -91.72 0.13 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.3 p -171.81 179.29 2.8 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.57 ' CB ' ' H ' ' A' ' 10' ' ' LYS . 80.1 m -96.09 115.75 27.91 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.443 ' ND2' ' H ' ' A' ' 22' ' ' TYR . 0.7 OUTLIER -92.46 109.05 20.43 Favored 'General case' 0 N--CA 1.498 1.957 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.408 179.843 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . 0.408 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.443 ' H ' ' ND2' ' A' ' 20' ' ' ASN . 20.2 m-85 -88.77 -18.8 26.99 Favored 'General case' 0 N--CA 1.504 2.264 0 CA-C-O 122.129 0.966 . . . . 0.0 108.671 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.6 p -119.6 -9.01 9.88 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 112.873 -1.967 . . . . 0.0 107.624 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt 51.45 26.57 3.25 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 124.81 1.319 . . . . 0.0 108.321 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -133.54 177.99 7.27 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 103.864 -2.643 . . . . 0.0 103.864 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 89.2 m -95.39 153.46 17.68 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -65.12 152.76 42.75 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.759 0.79 . . . . 0.0 109.467 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.416 0 O-C-N 119.594 -1.941 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.421 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 23.1 p . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 121.184 0.516 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -116.3 168.23 10.32 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.732 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.4 p -56.15 161.53 2.38 Favored 'General case' 0 N--CA 1.497 1.906 0 CA-C-N 114.448 -1.251 . . . . 0.0 112.31 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.88 4.37 85.55 Favored Glycine 0 N--CA 1.485 1.965 0 O-C-N 124.884 1.365 . . . . 0.0 112.145 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.5 t -69.02 152.82 44.77 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 106.7 -1.593 . . . . 0.0 106.7 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 63.3 m -74.29 104.42 5.05 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 117.866 2.543 . . . . 0.0 117.866 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.626 ' SG ' ' N ' ' A' ' 12' ' ' SER . 2.2 t -88.9 137.94 31.86 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.6 t -77.74 78.53 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.9 tttp 63.53 -70.14 0.07 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 113.046 -1.888 . . . . 0.0 110.656 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.1 p -125.32 27.9 6.46 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 123.327 0.392 . . . . 0.0 111.923 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.626 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 90.2 p -68.45 107.17 2.78 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -74.47 82.54 1.96 Allowed 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 45.9 p30 -147.09 5.57 0.85 Allowed 'General case' 0 N--CA 1.493 1.691 0 CA-C-N 112.754 -2.021 . . . . 0.0 109.882 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 72.9 m -95.35 128.25 42.05 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.292 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.421 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 67.5 m -55.09 -30.66 60.14 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 53.5 mmm-85 -90.58 -94.08 0.12 Allowed 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 104.821 -2.289 . . . . 0.0 104.821 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 p -177.83 176.09 1.24 Allowed 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.484 ' SG ' ' O ' ' A' ' 12' ' ' SER . 75.3 m -90.66 106.32 18.42 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 116.16 1.911 . . . . 0.0 116.16 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.488 HD22 ' H ' ' A' ' 23' ' ' THR . 0.4 OUTLIER -84.29 109.08 17.53 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 106.341 -1.725 . . . . 0.0 106.341 179.597 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.44 ' HB2' HD21 ' A' ' 20' ' ' ASN . 50.0 m-85 -88.92 -24.29 22.5 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 106.911 -1.515 . . . . 0.0 106.911 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.488 ' H ' HD22 ' A' ' 20' ' ' ASN . 41.4 p -121.25 5.72 10.24 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 112.872 -1.967 . . . . 0.0 109.122 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 35.13 30.93 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.472 0 O-C-N 125.34 1.65 . . . . 0.0 113.117 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.45 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 15.2 ptm180 -127.32 -168.02 1.82 Allowed 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 112.042 -2.345 . . . . 0.0 105.539 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 83.5 m -95.34 152.39 18.42 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.614 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -65.6 167.38 9.09 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 122.195 0.998 . . . . 0.0 111.236 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.424 0 O-C-N 119.838 -1.789 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.5 p . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.172 0.51 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -84.93 160.25 20.15 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 114.591 -1.186 . . . . 0.0 109.955 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.0 m -58.34 146.95 32.72 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.437 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 147.04 19.95 0.11 Allowed Glycine 0 N--CA 1.484 1.869 0 CA-C-N 113.645 -1.616 . . . . 0.0 110.982 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 69.3 m -78.76 135.93 37.25 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.9 t -55.18 91.79 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 O-C-N 124.532 1.145 . . . . 0.0 113.609 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.1 -169.46 2.26 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.092 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.0 m -143.22 -50.71 0.34 Allowed 'General case' 0 N--CA 1.494 1.742 0 CA-C-N 114.568 -1.196 . . . . 0.0 108.019 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.475 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 5.6 ttpm? -167.55 -47.76 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.968 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 t -89.61 68.04 7.6 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.149 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -88.77 39.46 0.92 Allowed 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 114.496 -1.229 . . . . 0.0 113.743 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -62.06 -24.09 66.88 Favored 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -57.82 -43.4 85.71 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-N 114.259 -1.337 . . . . 0.0 108.858 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.5 m -83.75 138.12 33.42 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 124.526 1.141 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.21 -22.14 65.69 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 123.776 0.672 . . . . 0.0 110.883 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -89.44 -111.81 0.07 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 124.075 0.859 . . . . 0.0 108.814 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.9 p -163.79 -156.35 0.35 Allowed 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 117.751 -1.118 . . . . 0.0 109.173 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.5 t -117.19 109.89 17.47 Favored 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 115.992 1.849 . . . . 0.0 115.992 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -82.42 113.53 20.24 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 114.902 -1.044 . . . . 0.0 108.241 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -88.93 -4.27 58.5 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 124.397 1.061 . . . . 0.0 109.008 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.401 ' OG1' ' HG2' ' A' ' 25' ' ' ARG . 41.4 p -139.1 -9.29 1.31 Allowed 'General case' 0 N--CA 1.492 1.636 0 CA-C-N 113.016 -1.902 . . . . 0.0 108.896 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.471 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 7.0 mtpm? 49.34 29.21 2.64 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 124.771 1.294 . . . . 0.0 108.469 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.401 ' HG2' ' OG1' ' A' ' 23' ' ' THR . 5.6 ptp180 -130.33 170.22 14.43 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 104.822 -2.288 . . . . 0.0 104.822 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 94.8 m -77.0 152.83 35.03 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -67.68 154.24 41.91 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.767 -0.773 . . . . 0.0 109.312 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.415 0 O-C-N 119.797 -1.815 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.1 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.545 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 2.5 mppt? -92.32 157.55 16.58 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.406 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 54.0 m -57.65 150.97 18.19 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 123.23 0.331 . . . . 0.0 111.433 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.469 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 142.89 7.93 0.59 Allowed Glycine 0 N--CA 1.485 1.928 0 CA-C-N 112.982 -1.917 . . . . 0.0 108.706 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.1 m -65.99 143.35 57.43 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.8 t -50.64 96.41 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 O-C-N 125.355 1.66 . . . . 0.0 114.455 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 47.9 t -140.71 149.42 42.17 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.588 0.709 . . . . 0.0 111.494 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.1 m -151.8 -65.03 0.18 Allowed 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.472 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 3.8 mmmp? -148.43 19.75 1.06 Allowed 'General case' 0 N--CA 1.499 2.012 0 O-C-N 124.847 1.342 . . . . 0.0 109.061 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -114.87 -63.18 1.49 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 123.648 0.593 . . . . 0.0 111.635 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 49.3 m -62.95 143.56 57.61 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 123.915 0.759 . . . . 0.0 109.161 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.411 ' HB2' ' HZ2' ' A' ' 2' ' ' LYS . 97.4 m-85 -67.42 21.98 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.8 m120 68.17 115.51 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 CA-C-O 122.35 1.071 . . . . 0.0 113.887 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 2' ' ' LYS . 72.2 m -57.54 170.49 0.54 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 112.248 -2.251 . . . . 0.0 110.312 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 99.0 m -53.22 -20.89 4.5 Favored 'General case' 0 N--CA 1.5 2.026 0 C-N-CA 120.587 -0.445 . . . . 0.0 112.026 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -89.52 -76.22 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 104.704 -2.332 . . . . 0.0 104.704 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.6 p 175.19 178.4 0.15 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 124.641 1.213 . . . . 0.0 109.612 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -104.91 120.56 41.73 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.516 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -99.93 109.11 21.48 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 123.957 0.786 . . . . 0.0 109.74 179.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -89.13 18.29 5.14 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 124.027 0.829 . . . . 0.0 112.23 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.3 m -136.16 -11.58 1.94 Allowed 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 106.252 -1.759 . . . . 0.0 106.252 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm 53.29 31.86 12.53 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.417 ' HA ' ' H ' ' A' ' 8' ' ' CYS . 81.4 mtt85 -148.84 178.05 9.0 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 112.808 -1.996 . . . . 0.0 110.478 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.469 ' HB2' ' H ' ' A' ' 5' ' ' GLY . 62.0 m -95.94 -178.49 4.37 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 20' ' ' ASN . 73.3 m-85 -95.13 171.55 8.67 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.548 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.506 0 O-C-N 119.917 -1.739 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.457 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 17.1 p . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 121.276 0.56 . . . . 0.0 111.956 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 2' ' ' LYS . 1.8 mppt? -94.9 165.41 12.47 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.602 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.6 p -62.75 155.95 25.15 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.542 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.507 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 70.43 8.93 63.65 Favored Glycine 0 N--CA 1.488 2.14 0 O-C-N 125.168 1.542 . . . . 0.0 113.564 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.468 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 32.0 t -64.94 133.29 51.46 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 77.7 p -63.84 84.51 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -179.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 23.0 p -126.83 123.95 38.51 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.367 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.5 p -34.44 -101.53 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 118.423 2.749 . . . . 0.0 118.423 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.438 ' NZ ' ' HB3' ' A' ' 10' ' ' LYS . 0.2 OUTLIER -148.07 -34.42 0.23 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 118.396 0.544 . . . . 0.0 111.827 -179.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -89.58 -10.33 46.47 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 124.47 1.106 . . . . 0.0 110.463 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 57.1 m -59.21 -65.26 0.7 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.05 -0.977 . . . . 0.0 113.538 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.426 ' N ' ' SG ' ' A' ' 19' ' ' CYS . 36.3 m-85 55.2 19.39 2.87 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 124.064 0.852 . . . . 0.0 110.182 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.2 p-10 -58.87 -34.88 72.12 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 92.0 m -69.23 151.01 46.81 Favored 'General case' 0 N--CA 1.499 2.016 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.457 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 46.9 m -44.17 -39.55 4.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 125.557 1.786 . . . . 0.0 108.686 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.421 ' HE ' ' HB3' ' A' ' 27' ' ' TYR . 54.1 ttt85 -89.81 -94.15 0.11 Allowed 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 105.569 -2.012 . . . . 0.0 105.569 179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.7 p -171.26 176.36 3.93 Favored 'General case' 0 N--CA 1.509 2.515 0 CA-C-N 119.391 0.996 . . . . 0.0 112.691 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 80.5 m -106.22 112.15 25.06 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 123.939 0.775 . . . . 0.0 113.066 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.508 HD22 HG21 ' A' ' 23' ' ' THR . 60.6 t30 -83.96 131.09 34.87 Favored 'General case' 0 N--CA 1.496 1.843 0 CA-C-N 114.524 -1.216 . . . . 0.0 110.095 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . 0.463 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.9 p90 -89.04 21.25 3.22 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-O 123.035 1.398 . . . . 0.0 112.918 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.508 HG21 HD22 ' A' ' 20' ' ' ASN . 7.8 t -150.9 -13.04 0.22 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-N 111.653 -2.522 . . . . 0.0 106.471 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? 38.79 41.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 125.241 1.588 . . . . 0.0 110.958 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.483 ' HA ' ' HA ' ' A' ' 7' ' ' SER . 9.2 ptm180 -139.2 164.22 30.38 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 102.978 -2.971 . . . . 0.0 102.978 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.868 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 89.4 m -75.7 165.4 25.11 Favored 'General case' 0 C--N 1.307 -1.281 0 C-N-CA 118.51 -1.276 . . . . 0.0 113.183 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.421 ' HB3' ' HE ' ' A' ' 17' ' ' ARG . 80.2 m-85 -76.23 166.34 23.6 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 114.387 -1.279 . . . . 0.0 110.181 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.456 0 O-C-N 119.864 -1.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.0 p . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.475 0.655 . . . . 0.0 109.523 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.467 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 11.8 mptt -89.18 179.85 6.04 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.967 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 81.6 p -63.33 154.87 30.42 Favored 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.633 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -176.79 18.92 0.04 OUTLIER Glycine 0 N--CA 1.482 1.701 0 N-CA-C 109.351 -1.5 . . . . 0.0 109.351 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.409 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 67.5 m -64.12 133.3 52.72 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.6 p -58.31 89.04 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.422 0 O-C-N 124.947 1.404 . . . . 0.0 114.309 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 38.1 t -89.38 145.74 25.14 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.828 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.1 p -100.45 46.86 0.94 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp 65.56 -2.37 0.85 Allowed 'General case' 0 N--CA 1.503 2.198 0 CA-C-N 114.199 -1.364 . . . . 0.0 111.945 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 59.8 p -143.32 80.46 1.67 Allowed 'General case' 0 N--CA 1.495 1.803 0 CA-C-O 121.651 0.738 . . . . 0.0 110.805 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.535 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . 39.4 t -159.54 82.91 0.75 Allowed 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -76.17 5.17 7.24 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 114.044 -1.435 . . . . 0.0 110.67 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.505 ' H ' HD22 ' A' ' 14' ' ' ASN . 6.6 m-80 -55.3 -39.52 70.0 Favored 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.372 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 76.2 m -71.14 150.79 45.08 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.788 0.68 . . . . 0.0 109.904 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 94.3 m -58.56 -35.98 73.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 123.684 0.615 . . . . 0.0 112.142 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -89.73 -101.68 0.1 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 117.808 -1.091 . . . . 0.0 111.523 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.9 p -166.37 -171.73 2.01 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 119.636 1.107 . . . . 0.0 112.152 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 88.7 m -96.39 114.43 26.1 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.477 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.2 OUTLIER -92.21 110.48 21.87 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -89.4 16.11 8.08 Favored 'General case' 0 N--CA 1.501 2.102 0 CA-C-O 122.35 1.071 . . . . 0.0 110.945 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' LYS . 59.1 m -143.71 -7.81 0.75 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' THR . 24.1 pttm 37.71 34.32 0.05 Allowed 'General case' 0 N--CA 1.507 2.396 0 CA-C-O 122.811 1.291 . . . . 0.0 111.563 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.2 mtt85 -142.31 170.86 14.91 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 111.391 -2.64 . . . . 0.0 108.694 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.5 m -84.89 157.76 20.79 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.36 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -73.1 157.91 36.36 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.58 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.421 0 O-C-N 119.854 -1.779 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.7 p . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.397 0.618 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -84.53 177.64 8.02 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.57 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m -53.88 136.07 41.21 Favored 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 115.032 -0.985 . . . . 0.0 113.079 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 97.64 -7.67 63.49 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 34.4 t -56.67 144.51 32.03 Favored 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 61.4 m -66.12 86.09 0.1 Allowed 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.433 ' SG ' ' OG ' ' A' ' 12' ' ' SER . 37.3 t -89.85 120.14 30.83 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.668 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.7 t -124.02 63.18 1.07 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt 79.66 -49.03 0.38 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-N 112.939 -1.937 . . . . 0.0 109.925 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 70.0 p -89.59 107.97 19.39 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 123.848 0.718 . . . . 0.0 110.992 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.433 ' OG ' ' SG ' ' A' ' 8' ' ' CYS . 89.6 p -169.19 3.94 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.605 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.408 ' H ' ' H ' ' A' ' 12' ' ' SER . 88.7 m-85 56.35 22.0 5.94 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 123.685 0.616 . . . . 0.0 111.083 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 42.6 t30 63.01 106.21 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.153 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 70.3 m -59.5 166.17 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-N 113.959 -1.473 . . . . 0.0 109.52 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.0 m -36.19 -43.63 0.36 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 124.234 0.959 . . . . 0.0 112.362 179.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 17' ' ' ARG . 55.5 mtt-85 -101.83 -96.78 0.28 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 107.543 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 78.7 p -168.7 147.28 4.13 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 75.7 m -66.8 143.64 56.78 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.916 -1.947 . . . . 0.0 113.506 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.406 ' HB2' ' CE1' ' A' ' 27' ' ' TYR . 49.7 t30 -131.95 104.6 6.93 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -88.58 -47.86 7.99 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 103.995 -2.594 . . . . 0.0 103.995 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.7 p -90.01 -10.18 45.86 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 113.445 -1.707 . . . . 0.0 107.52 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 67.5 mttm 51.97 33.58 12.05 Favored 'General case' 0 N--CA 1.502 2.136 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -141.11 152.01 44.41 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 110.742 -2.935 . . . . 0.0 109.464 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 19' ' ' CYS . 95.6 m -83.47 -178.27 7.0 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.615 0.722 . . . . 0.0 110.108 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 20' ' ' ASN . 19.6 m-85 -95.64 153.06 17.91 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 114.087 -1.415 . . . . 0.0 107.606 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.362 0 O-C-N 119.912 -1.743 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.491 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 14.2 p . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 121.02 0.438 . . . . 0.0 112.176 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.452 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 10.1 mtmp? -83.69 -179.08 7.22 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.188 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 80.7 p -58.99 151.35 22.24 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 115.019 -0.991 . . . . 0.0 112.28 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.422 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 174.84 8.78 0.02 OUTLIER Glycine 0 N--CA 1.486 2.002 0 CA-C-N 114.539 -1.209 . . . . 0.0 110.44 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.457 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 61.3 m -64.08 134.04 54.17 Favored 'General case' 0 N--CA 1.496 1.84 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 51.6 m -60.6 90.99 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 124.696 1.247 . . . . 0.0 114.161 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 28.3 p -149.33 168.28 23.8 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.246 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -169.77 164.02 9.89 Favored 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 113.909 -1.496 . . . . 0.0 110.531 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp 48.99 -99.65 0.06 Allowed 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 91.7 m -89.34 78.72 7.17 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.98 0.895 . . . . 0.0 109.649 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.443 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 59.4 m -155.05 116.11 3.97 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.101 -1.815 . . . . 0.0 106.101 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -135.45 84.56 2.1 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -140.1 -48.75 0.45 Allowed 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.779 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 92.9 m -57.51 141.66 46.96 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.491 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.3 m -46.46 -33.7 4.19 Favored 'General case' 0 N--CA 1.492 1.646 0 CA-C-N 113.006 -1.906 . . . . 0.0 110.634 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -99.26 -93.34 0.26 Allowed 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.0 p -174.59 -178.19 1.3 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 76.7 m -98.8 109.28 22.06 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.596 HD22 ' H ' ' A' ' 23' ' ' THR . 6.6 t30 -79.86 109.49 14.33 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.613 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . 0.435 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.459 ' HB2' HD21 ' A' ' 20' ' ' ASN . 72.3 m-85 -88.79 -41.05 12.75 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.596 ' H ' HD22 ' A' ' 20' ' ' ASN . 74.7 p -90.99 -9.72 44.96 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.835 -1.53 . . . . 0.0 107.556 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 54.69 28.45 10.11 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.747 -1.575 . . . . 0.0 106.747 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -139.05 166.52 24.28 Favored 'General case' 0 N--CA 1.489 1.486 0 CA-C-N 111.253 -2.703 . . . . 0.0 108.501 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 90.4 m -79.23 154.76 28.96 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -61.77 98.62 0.1 Allowed 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 113.442 -1.708 . . . . 0.0 110.566 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.394 0 O-C-N 119.614 -1.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 18.6 p . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 121.569 0.699 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -96.08 147.44 23.72 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 113.655 -1.611 . . . . 0.0 107.775 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 57.5 m -53.07 157.16 1.87 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 124.293 0.996 . . . . 0.0 112.359 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.421 ' H ' ' HB2' ' A' ' 26' ' ' CYS . . . 76.87 9.0 86.77 Favored Glycine 0 N--CA 1.489 2.218 0 O-C-N 124.759 1.287 . . . . 0.0 112.249 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.488 ' HB3' ' SG ' ' A' ' 26' ' ' CYS . 33.1 t -65.06 140.13 58.8 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 106.514 -1.661 . . . . 0.0 106.514 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 56.2 m -63.59 91.5 0.06 Allowed 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.9 t -106.71 126.24 52.03 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 115.027 -0.988 . . . . 0.0 108.41 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.5 m -140.71 84.86 1.96 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 124.158 0.911 . . . . 0.0 110.932 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? 52.8 25.94 4.2 Favored 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.411 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.8 p -145.66 -43.49 0.21 Allowed 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 m -85.0 57.55 4.51 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.538 1.31 . . . . 0.0 114.538 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -80.38 80.64 6.79 Favored 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 122.478 1.133 . . . . 0.0 108.207 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 41.6 p30 -162.3 15.34 0.08 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 112.889 -1.959 . . . . 0.0 109.87 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 19' ' ' CYS . 81.9 m -65.23 126.31 27.77 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.1 m -45.0 -39.69 5.81 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -94.66 -83.33 0.35 Allowed 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.7 p -176.62 170.62 2.41 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 123.813 0.696 . . . . 0.0 110.838 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.486 ' SG ' ' SG ' ' A' ' 15' ' ' CYS . 87.3 m -94.24 112.67 24.49 Favored 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.526 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -87.86 116.38 25.98 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 114.539 -1.209 . . . . 0.0 107.797 179.751 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . 0.452 ' C ' ' H ' ' A' ' 23' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -88.83 25.13 1.85 Allowed 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 122.704 1.24 . . . . 0.0 111.423 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.452 ' H ' ' C ' ' A' ' 21' ' ' HYP . 65.0 p -150.11 -15.54 0.25 Allowed 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 112.368 -2.197 . . . . 0.0 107.59 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp 50.3 31.93 5.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 124.399 1.062 . . . . 0.0 109.261 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -136.43 173.38 11.77 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 105.599 -2.0 . . . . 0.0 105.599 -179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 6' ' ' SER . 73.7 m -89.32 149.12 23.18 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.972 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CE1' ' HA ' ' A' ' 20' ' ' ASN . 82.7 m-85 -62.96 144.3 56.93 Favored 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 121.983 0.897 . . . . 0.0 110.247 179.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.368 0 O-C-N 119.426 -2.046 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 120.787 0.327 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -97.1 165.45 12.06 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 48.7 m -49.68 149.68 2.37 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 123.777 0.673 . . . . 0.0 110.843 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.449 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 167.81 13.74 0.02 OUTLIER Glycine 0 N--CA 1.486 2.0 0 CA-C-N 113.697 -1.592 . . . . 0.0 109.797 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.429 ' H ' ' H ' ' A' ' 5' ' ' GLY . 31.9 t -74.12 147.21 42.91 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.3 t -66.13 96.33 0.32 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 124.327 1.017 . . . . 0.0 108.972 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.6 p -89.62 165.44 14.24 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-N 114.511 -1.222 . . . . 0.0 111.388 -179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.8 m -66.64 -69.32 0.31 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.848 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -164.32 -39.84 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.852 0.72 . . . . 0.0 109.294 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -142.8 23.78 1.89 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.524 -1.217 . . . . 0.0 108.111 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.0 t -55.43 111.71 0.95 Allowed 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.455 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -69.59 -8.09 44.34 Favored 'General case' 0 N--CA 1.493 1.676 0 CA-C-N 113.802 -1.545 . . . . 0.0 111.596 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -58.49 -32.85 69.17 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 123.834 0.709 . . . . 0.0 109.652 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 80.4 m -57.23 129.78 43.27 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 124.204 0.94 . . . . 0.0 111.671 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 68.7 m -51.3 -41.41 60.48 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' HA ' HH11 ' A' ' 17' ' ' ARG . 8.7 mmm180 -93.75 -80.81 0.38 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 113.475 -1.693 . . . . 0.0 108.785 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.466 ' HG ' ' HD2' ' A' ' 27' ' ' TYR . 33.0 p -174.11 176.13 2.59 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 123.973 0.796 . . . . 0.0 109.643 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.5 t -97.31 111.15 23.53 Favored 'General case' 0 N--CA 1.501 2.117 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 -179.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.551 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 1.1 t-20 -83.33 109.93 17.69 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.637 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.433 ' H ' ' ND2' ' A' ' 20' ' ' ASN . 20.6 m-85 -89.02 -43.61 10.99 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.8 p -97.97 6.15 48.02 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 113.93 -1.486 . . . . 0.0 109.442 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.2 pttm 41.93 31.8 0.25 Allowed 'General case' 0 N--CA 1.51 2.562 0 CA-C-O 123.589 1.662 . . . . 0.0 110.007 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -136.42 -178.54 5.21 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 110.514 -3.039 . . . . 0.0 107.643 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.449 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 81.0 m -85.86 144.62 27.6 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.405 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.551 ' CE2' ' HA ' ' A' ' 20' ' ' ASN . 65.9 m-85 -58.84 105.57 0.32 Allowed 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.912 0.863 . . . . 0.0 109.892 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.354 0 O-C-N 119.407 -2.058 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.48 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 10.8 p . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -71.84 159.7 33.84 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 113.867 -1.515 . . . . 0.0 108.363 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.0 m -55.41 149.12 13.8 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 123.803 0.69 . . . . 0.0 111.415 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.421 ' H ' ' H ' ' A' ' 6' ' ' SER . . . 171.48 -3.07 0.03 OUTLIER Glycine 0 N--CA 1.488 2.131 0 CA-C-N 113.619 -1.628 . . . . 0.0 109.255 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.421 ' H ' ' H ' ' A' ' 5' ' ' GLY . 69.2 m -53.14 123.28 11.33 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.1 p -67.18 80.58 0.13 Allowed 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.709 1.256 . . . . 0.0 113.952 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 5.9 p -109.85 120.06 41.28 Favored 'General case' 0 N--CA 1.493 1.688 0 CA-C-O 121.945 0.878 . . . . 0.0 112.783 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.0 m -112.54 100.94 9.13 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 112.585 -2.098 . . . . 0.0 108.341 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.512 ' N ' ' HD2' ' A' ' 10' ' ' LYS . 10.5 mptt 58.48 7.99 0.79 Allowed 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.156 0.91 . . . . 0.0 112.873 179.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 62.6 p -141.19 107.78 5.33 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 123.438 0.461 . . . . 0.0 110.055 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.529 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 41.5 t -157.31 140.98 15.86 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-N 115.077 -0.965 . . . . 0.0 108.476 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -81.25 -53.13 6.62 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.5 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.457 HD22 ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -178.45 77.47 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 115.12 1.526 . . . . 0.0 115.12 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 61.2 m -68.4 145.39 54.17 Favored 'General case' 0 N--CA 1.5 2.07 0 C-N-CA 119.061 -1.056 . . . . 0.0 111.014 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.48 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 34.1 m -47.94 -28.57 2.78 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 124.995 1.434 . . . . 0.0 109.075 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 51.7 mmm-85 -116.47 -110.86 0.35 Allowed 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 106.163 -1.792 . . . . 0.0 106.163 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 76.6 p -173.72 140.63 0.78 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 121.219 0.533 . . . . 0.0 110.563 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.529 ' SG ' ' HB2' ' A' ' 12' ' ' SER . 58.9 m -51.63 103.52 0.06 Allowed 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 1.5 t-20 -76.38 115.06 15.76 Favored 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -89.51 -17.39 28.71 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 124.56 1.162 . . . . 0.0 108.85 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -132.31 2.74 3.9 Favored 'General case' 0 N--CA 1.495 1.793 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.001 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 pttm 40.95 33.4 0.21 Allowed 'General case' 0 N--CA 1.506 2.373 0 O-C-N 124.978 1.424 . . . . 0.0 109.632 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 20' ' ' ASN . 90.1 mtt-85 -138.36 139.7 39.12 Favored 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 111.284 -2.689 . . . . 0.0 108.969 -179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.83 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 67.1 m -65.42 144.17 57.24 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.737 1.256 . . . . 0.0 113.815 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -56.72 164.87 1.34 Allowed 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 111.94 -2.391 . . . . 0.0 111.701 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.462 0 O-C-N 119.945 -1.722 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.408 ' SG ' ' N ' ' A' ' 16' ' ' CYS . 69.2 m . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.553 ' HG3' ' H ' ' A' ' 3' ' ' SER . 52.7 tptt -107.51 -134.53 0.34 Allowed 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.553 ' H ' ' HG3' ' A' ' 2' ' ' LYS . 80.9 p -95.75 163.43 13.18 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -175.63 19.6 0.05 OUTLIER Glycine 0 N--CA 1.486 1.988 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.57 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 29.5 m -64.68 142.0 58.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.4 p -54.92 83.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 O-C-N 125.514 1.759 . . . . 0.0 115.624 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.5 t -143.57 132.7 23.04 Favored 'General case' 0 N--CA 1.496 1.836 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.146 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 41.2 t -79.97 -71.96 0.43 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 114.075 -1.421 . . . . 0.0 113.457 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 10' ' ' LYS . 4.8 ttmp? -118.91 -46.3 2.54 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.7 t -151.01 125.12 9.3 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 72.1 m -138.99 -8.78 1.35 Allowed 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 112.903 -1.953 . . . . 0.0 108.823 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 60.74 5.93 1.04 Allowed 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 114.479 1.289 . . . . 0.0 114.479 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -82.11 -77.83 0.22 Allowed 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.11 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 71.3 m -44.34 130.11 6.45 Favored 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' N ' ' SG ' ' A' ' 1' ' ' CYS . 90.3 m -66.12 -15.58 63.23 Favored 'General case' 0 N--CA 1.493 1.694 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.461 ' NE ' ' HA ' ' A' ' 17' ' ' ARG . 2.9 mmp_? -90.01 -110.94 0.08 Allowed 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 179.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 61.5 p -161.19 171.53 18.3 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.1 m -100.18 122.29 42.79 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -179.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.494 HD22 ' C ' ' A' ' 20' ' ' ASN . 0.1 OUTLIER -94.03 117.77 30.56 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . 0.419 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -89.51 17.56 6.21 Favored 'General case' 0 N--CA 1.502 2.168 0 CA-C-O 122.678 1.228 . . . . 0.0 111.425 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.405 ' H ' ' C ' ' A' ' 21' ' ' HYP . 81.2 p -148.7 -9.56 0.35 Allowed 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 112.26 -2.245 . . . . 0.0 105.696 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 40.46 32.51 0.14 Allowed 'General case' 0 N--CA 1.5 2.071 0 CA-C-O 123.398 1.57 . . . . 0.0 112.137 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -132.64 164.97 25.53 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 110.282 -3.145 . . . . 0.0 106.663 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 80.0 m -85.95 161.5 18.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.349 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -75.02 147.1 41.03 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.823 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.421 0 O-C-N 119.517 -1.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.405 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 26.8 p . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -87.67 162.79 16.9 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.5 p -47.67 145.87 2.52 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 124.007 0.817 . . . . 0.0 112.928 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 166.6 -11.6 0.07 OUTLIER Glycine 0 N--CA 1.485 1.949 0 CA-C-N 113.208 -1.815 . . . . 0.0 110.328 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.523 ' HB2' ' SG ' ' A' ' 15' ' ' CYS . 38.5 m -44.6 135.18 5.0 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 76.8 p -64.22 90.43 0.07 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 124.579 1.174 . . . . 0.0 113.203 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.7 p -100.69 -155.12 0.5 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.445 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.8 p -154.02 -50.92 0.09 Allowed 'General case' 0 N--CA 1.495 1.804 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.037 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -167.37 -35.26 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 124.018 0.824 . . . . 0.0 109.843 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 99.3 m -115.17 94.14 4.6 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.146 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.8 t -158.65 61.88 0.43 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.036 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -66.6 -15.05 63.16 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.987 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -58.3 -31.49 67.55 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 124.206 0.942 . . . . 0.0 111.568 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 6' ' ' SER . 67.5 m -62.07 130.21 44.46 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.479 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.405 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 60.8 m -39.79 -43.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 125.246 1.591 . . . . 0.0 113.022 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -98.21 -82.69 0.42 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 123.987 0.804 . . . . 0.0 109.32 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.2 p -172.1 168.38 5.82 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 123.485 0.49 . . . . 0.0 110.866 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -91.25 135.76 33.57 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 114.686 1.365 . . . . 0.0 114.686 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -109.04 105.14 14.52 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 124.902 1.376 . . . . 0.0 108.903 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -89.17 -28.82 19.76 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.5 p -115.65 -1.93 12.59 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 113.959 -1.473 . . . . 0.0 110.588 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm 54.07 28.92 9.44 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.48 168.35 19.64 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 104.691 -2.337 . . . . 0.0 104.691 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 57.2 m -93.03 150.23 20.67 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.478 -0.889 . . . . 0.0 113.019 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -61.76 133.4 55.47 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.51 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.396 0 O-C-N 119.766 -1.834 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.523 ' HB2' ' N ' ' A' ' 16' ' ' CYS . 9.8 p . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -89.6 172.91 8.62 Favored 'General case' 0 N--CA 1.499 1.991 0 CA-C-N 114.389 -1.278 . . . . 0.0 109.908 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 82.6 p -47.9 153.34 0.64 Allowed 'General case' 0 N--CA 1.497 1.897 0 CA-C-N 114.669 -1.15 . . . . 0.0 112.394 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.425 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . -176.74 5.83 0.03 OUTLIER Glycine 0 N--CA 1.479 1.506 0 CA-C-O 118.358 -1.246 . . . . 0.0 111.231 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 36.3 t -57.17 135.81 56.41 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 118.399 1.1 . . . . 0.0 108.123 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 42.4 t -70.87 84.85 0.67 Allowed 'General case' 0 N--CA 1.487 1.405 0 O-C-N 124.611 1.194 . . . . 0.0 110.564 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 8.3 p -115.29 142.09 47.14 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.7 t -93.69 -172.05 2.77 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 111.988 -2.369 . . . . 0.0 110.169 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 10' ' ' LYS . 2.1 mppt? -63.56 -19.86 65.16 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -89.82 17.62 6.47 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 123.397 0.436 . . . . 0.0 110.817 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.451 ' O ' ' SG ' ' A' ' 19' ' ' CYS . 45.0 t -158.62 134.23 8.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.696 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.47 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 69.5 m-85 -145.09 27.25 1.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 CA-C-N 113.816 -1.538 . . . . 0.0 107.087 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -54.23 -28.13 39.25 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-N 114.048 -1.433 . . . . 0.0 114.393 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 71.4 m -65.59 155.69 35.02 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.523 ' N ' ' HB2' ' A' ' 1' ' ' CYS . 36.2 m -52.85 -39.85 62.89 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-N 112.374 -2.194 . . . . 0.0 111.417 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.47 ' N ' ' HD2' ' A' ' 17' ' ' ARG . 2.2 mpt_? -92.54 -89.01 0.2 Allowed 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.1 p -173.62 -172.99 0.82 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.47 ' SG ' ' HA ' ' A' ' 13' ' ' TYR . 73.9 m -108.72 104.27 13.53 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -68.97 115.25 8.06 Favored 'General case' 0 N--CA 1.495 1.802 0 CA-C-N 114.278 -1.328 . . . . 0.0 109.304 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -88.69 -47.63 8.11 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 60.2 p -91.84 -7.72 48.58 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 113.686 -1.597 . . . . 0.0 108.731 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HB3' ' NZ ' ' A' ' 24' ' ' LYS . 6.8 mtpm? 54.26 27.05 7.4 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -133.96 167.63 20.26 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 111.888 -2.415 . . . . 0.0 110.073 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.899 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 93.7 m -82.9 154.32 24.65 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.494 1.14 . . . . 0.0 113.852 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 94.4 m-85 -69.29 130.97 44.1 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 112.513 -2.13 . . . . 0.0 108.736 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.383 0 O-C-N 119.388 -2.07 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -99.43 163.12 12.65 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-N 114.755 -1.111 . . . . 0.0 108.108 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.9 m -59.33 147.88 34.36 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.416 ' N ' ' HB2' ' A' ' 26' ' ' CYS . . . 163.18 3.94 0.05 OUTLIER Glycine 0 N--CA 1.484 1.862 0 CA-C-N 114.159 -1.382 . . . . 0.0 111.66 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.6 t -66.18 152.41 44.88 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -67.28 88.21 0.18 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 124.285 0.99 . . . . 0.0 111.499 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -93.4 148.65 21.87 Favored 'General case' 0 N--CA 1.494 1.74 0 CA-C-N 114.42 -1.264 . . . . 0.0 111.132 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.6 t -83.09 169.61 15.69 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -53.14 -51.78 60.83 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.602 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.4 t -97.93 59.12 1.41 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 124.365 1.041 . . . . 0.0 112.883 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 77.7 p -159.4 85.01 0.78 Allowed 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 122.194 0.997 . . . . 0.0 109.647 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -94.38 52.3 1.55 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.227 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.502 ' H ' HD22 ' A' ' 14' ' ' ASN . 3.9 m-80 -64.54 -35.86 82.32 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.065 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 77.1 m -66.08 146.68 54.39 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 124.13 0.894 . . . . 0.0 110.644 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 91.3 m -58.17 -18.45 25.78 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 123.738 0.649 . . . . 0.0 111.284 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 55.0 mmm-85 -89.46 -95.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 106.248 -1.76 . . . . 0.0 106.248 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.8 p -174.13 -172.49 0.71 Allowed 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 41.9 t -119.86 120.83 37.61 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.423 ' HA ' HD23 ' A' ' 21' ' ' HYP . 45.1 t-20 -91.63 106.96 18.87 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' HYP . . . . . 0.423 HD23 ' HA ' ' A' ' 20' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -88.74 -49.16 7.02 Favored 'General case' 0 N--CA 1.501 2.108 0 N-CA-C 104.337 -2.468 . . . . 0.0 104.337 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.419 HG23 ' H ' ' A' ' 25' ' ' ARG . 4.7 t -89.71 -4.86 57.52 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 112.771 -2.013 . . . . 0.0 107.812 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm 51.18 29.81 5.14 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 122.46 1.124 . . . . 0.0 108.733 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.419 ' H ' HG23 ' A' ' 23' ' ' THR . 52.6 mtp180 -135.59 157.41 46.95 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 111.839 -2.437 . . . . 0.0 110.025 -179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.416 ' HB2' ' N ' ' A' ' 5' ' ' GLY . 95.4 m -74.66 163.97 27.11 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.83 0.824 . . . . 0.0 112.369 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -76.75 95.55 4.04 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 113.708 -1.587 . . . . 0.0 109.82 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.399 0 O-C-N 119.497 -2.002 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_