data_1wjc_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 1wjc _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 full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.474 0.654 . . . . 1.1000000000000001 109.778 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 24.7 mt -72.26 -33.47 67.51 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.48 -0.762 . . . . 1.1200000000000001 110.519 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.91 -60.05 4.0 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.062 -1.024 . . . . 2.3100000000000001 110.447 -178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -60.04 -43.72 97.95 Favored Glycine 0 N--CA 1.494 2.509 0 C-N-CA 119.911 -1.138 . . . . 0.37 110.343 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 84.5 mt -60.15 -39.91 81.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 O-C-N 121.3 -1.118 . . . . 1.0900000000000001 110.466 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.99 -46.02 71.61 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.953 -1.092 . . . . 1.8700000000000001 108.167 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.7 mttp -68.71 -51.28 43.24 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.233 -0.917 . . . . 2.8500000000000001 109.257 178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.58 -34.13 73.74 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 109.231 -0.655 . . . . 1.0700000000000001 109.231 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -59.83 -42.72 94.17 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.124 -1.031 . . . . 1.5700000000000001 109.274 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -62.03 -41.27 97.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.104 -0.998 . . . . 1.76 109.151 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.41 ' OE2' ' CE2' ' A' ' 15' ' ' TYR . 54.9 tp10 -61.24 -40.12 92.86 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.222 -1.029 . . . . 2.5 108.222 179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.581 ' O ' ' N ' ' A' ' 16' ' ' HIS . 16.6 t60 -60.35 -48.73 80.5 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.18 -0.95 . . . . 0.22 109.706 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 76.5 tt0 -60.21 -40.5 90.37 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.122 -0.986 . . . . 1.8500000000000001 110.494 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mtpt -61.46 -39.88 92.49 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.328 -0.857 . . . . 2.0600000000000001 112.044 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.41 ' CE2' ' OE2' ' A' ' 11' ' ' GLU . 6.6 m-85 -131.55 -0.68 3.93 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.958 -1.089 . . . . 0.92000000000000004 112.682 -177.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.581 ' N ' ' O ' ' A' ' 12' ' ' HIS . 89.5 m-70 51.58 40.65 27.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.473 -1.392 . . . . 0.28000000000000003 107.429 -177.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 77.6 p -62.45 156.18 23.47 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.471 0.653 . . . . 0.88 110.204 -178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -73.5 160.03 32.32 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.505 -0.747 . . . . 1.8899999999999999 109.384 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -57.75 -27.54 63.11 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.227 -0.921 . . . . 0.39000000000000001 110.763 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.5 mtt180 -64.46 -45.06 89.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.824 -1.172 . . . . 3.5800000000000001 109.756 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.34 -46.8 81.92 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.499 -0.751 . . . . 1.0700000000000001 109.2 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 76.8 mtm -61.93 -41.28 97.76 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.462 -0.895 . . . . 1.1000000000000001 109.258 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.473 ' O ' ' N ' ' A' ' 27' ' ' ASN . . . -59.92 -44.23 94.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.474 -0.766 . . . . 1.0600000000000001 109.495 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.68 -36.89 70.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.419 -0.801 . . . . 1.5600000000000001 109.789 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -60.02 -46.89 88.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.174 -0.954 . . . . 1.8899999999999999 109.658 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -106.11 3.73 28.37 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.409 -0.807 . . . . 0.33000000000000002 110.608 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.473 ' N ' ' O ' ' A' ' 23' ' ' ALA . 18.2 m-20 54.4 45.39 27.23 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.006 -1.059 . . . . 2.5800000000000001 109.99 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.2 mt -109.88 149.99 40.74 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 120.839 -1.163 . . . . 1.0800000000000001 108.595 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -59.05 152.03 61.91 Favored 'Trans proline' 0 N--CA 1.489 1.237 0 C-N-CA 121.437 1.424 . . . . 0.70999999999999996 111.4 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -45.21 -33.86 8.98 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 C-N-CA 122.373 2.049 . . . . 0.82999999999999996 112.55 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 84.3 t -57.76 -49.97 79.1 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 O-C-N 121.436 -0.79 . . . . 1.1000000000000001 110.226 -178.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 60.7 t -65.57 -48.72 81.69 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.99 0 C-N-CA 118.326 -1.349 . . . . 1.05 109.131 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.42 -43.12 91.54 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.217 -0.927 . . . . 1.04 110.192 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -65.82 -34.29 77.81 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.792 -1.192 . . . . 2.2799999999999998 110.341 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.496 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -60.07 -40.01 88.03 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.809 -1.182 . . . . 1.1200000000000001 109.094 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.1 mt -60.06 -40.03 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 120.622 -1.299 . . . . 1.05 109.419 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.8 t -61.79 -40.01 85.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 N-CA-C 108.042 -1.095 . . . . 1.04 108.042 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.411 ' O ' ' OE1' ' A' ' 44' ' ' GLN . . . -62.84 -27.44 69.33 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.688 -0.633 . . . . 1.0900000000000001 110.157 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -81.48 -23.05 37.65 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.563 -1.336 . . . . 0.92000000000000004 108.471 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.7 t -84.61 103.0 13.35 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.377 -0.827 . . . . 0.23000000000000001 109.163 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.43 -30.25 69.52 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.425 -0.797 . . . . 1.1699999999999999 110.067 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -68.79 -41.83 78.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.181 -0.949 . . . . 2.2799999999999998 110.665 -178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 87.1 m -85.58 -22.77 27.91 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.049 -1.032 . . . . 0.40000000000000002 110.031 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.436 HE21 ' CG ' ' B' ' 44' ' ' GLN . 41.2 tt0 -78.45 -70.87 0.46 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.981 -1.074 . . . . 1.5600000000000001 108.96 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 mt -78.9 103.3 8.75 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 105.923 -1.88 . . . . 1.3600000000000001 105.923 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 36.2 tttt -106.89 8.17 30.49 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 115.323 -0.853 . . . . 3.6800000000000002 111.423 -175.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.711 0 O-C-N 120.269 -1.519 . . . . 2.9100000000000001 109.533 -179.724 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.465 0.65 . . . . 1.0800000000000001 109.806 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 24.8 mt -72.28 -33.47 67.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.477 -0.764 . . . . 1.1200000000000001 110.51 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.92 -60.06 3.98 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.994 -1.066 . . . . 2.3300000000000001 110.416 -178.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -59.99 -43.84 97.78 Favored Glycine 0 N--CA 1.493 2.45 0 C-N-CA 119.925 -1.131 . . . . 0.37 110.382 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 84.6 mt -60.0 -40.01 81.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 O-C-N 121.331 -1.1 . . . . 1.1200000000000001 110.46 -179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.99 -46.01 71.59 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.969 -1.082 . . . . 1.8700000000000001 108.209 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 29.7 mttp -68.71 -51.28 43.29 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.292 -0.88 . . . . 2.8599999999999999 109.285 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.11 73.58 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 109.301 -0.629 . . . . 1.0700000000000001 109.301 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -60.02 -42.58 94.64 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 119.045 -1.062 . . . . 1.54 109.252 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -62.02 -41.28 97.92 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.11 -0.994 . . . . 1.78 109.175 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.413 ' OE2' ' CE2' ' B' ' 15' ' ' TYR . 54.9 tp10 -61.3 -40.07 92.78 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.205 -1.035 . . . . 2.5099999999999998 108.205 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . 0.587 ' O ' ' N ' ' B' ' 16' ' ' HIS . 16.5 t60 -60.27 -49.06 79.12 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.236 -0.915 . . . . 0.20999999999999999 109.612 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -59.97 -40.58 89.54 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.102 -0.999 . . . . 1.8500000000000001 110.49 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mtpt -61.34 -39.96 92.5 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.277 -0.889 . . . . 2.0600000000000001 112.074 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' TYR . . . . . 0.413 ' CE2' ' OE2' ' B' ' 11' ' ' GLU . 6.6 m-85 -131.53 -0.73 3.94 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.914 -1.116 . . . . 0.91000000000000003 112.67 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . 0.587 ' N ' ' O ' ' B' ' 12' ' ' HIS . 89.4 m-70 51.55 40.68 27.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.435 -1.416 . . . . 0.28000000000000003 107.471 -177.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 77.7 p -62.49 156.16 23.66 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.487 0.661 . . . . 0.88 110.22 -178.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -73.51 160.03 32.3 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.523 -0.736 . . . . 1.8899999999999999 109.417 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 46.1 p-90 -57.79 -27.46 63.12 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.37 110.701 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 26.4 mtt180 -64.47 -45.09 88.89 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.784 -1.198 . . . . 3.5899999999999999 109.754 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.35 -46.82 81.78 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.514 -0.741 . . . . 1.0700000000000001 109.198 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 76.8 mtm -61.88 -41.3 97.7 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.527 -0.869 . . . . 1.1000000000000001 109.308 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' B' ' 27' ' ' ASN . . . -59.91 -44.3 94.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.486 -0.759 . . . . 1.0700000000000001 109.462 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.6 -36.97 71.0 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.356 -0.84 . . . . 1.6000000000000001 109.804 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -59.98 -46.95 87.79 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.132 -0.98 . . . . 1.8700000000000001 109.598 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -106.04 3.72 28.5 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.508 -0.745 . . . . 0.33000000000000002 110.668 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' B' ' 23' ' ' ALA . 18.4 m-20 54.5 45.29 27.31 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.011 -1.056 . . . . 2.5699999999999998 110.045 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 88.2 mt -109.85 150.02 40.78 Favored Pre-proline 0 N--CA 1.501 2.12 0 O-C-N 120.811 -1.181 . . . . 1.0700000000000001 108.62 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -59.15 152.04 62.37 Favored 'Trans proline' 0 N--CA 1.489 1.23 0 C-N-CA 121.45 1.433 . . . . 0.70999999999999996 111.368 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -45.18 -33.9 8.94 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 C-N-CA 122.403 2.069 . . . . 0.87 112.532 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 83.9 t -57.7 -50.08 78.66 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 O-C-N 121.377 -0.827 . . . . 1.1000000000000001 110.174 -178.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 60.6 t -65.51 -48.8 81.53 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.998 0 C-N-CA 118.302 -1.359 . . . . 1.04 109.144 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.29 -43.2 91.9 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.213 -0.93 . . . . 1.04 110.207 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 16.4 mtpt -65.85 -34.06 77.29 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.794 -1.192 . . . . 2.2599999999999998 110.399 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.481 ' OE2' ' O ' ' B' ' 35' ' ' GLU . 0.6 OUTLIER -60.29 -40.03 89.0 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.866 -1.146 . . . . 1.1200000000000001 109.054 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 73.9 mt -59.99 -40.04 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 120.642 -1.287 . . . . 1.05 109.453 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 72.5 t -61.8 -39.94 85.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 108.103 -1.073 . . . . 1.04 108.103 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' ALA . . . . . 0.556 ' O ' ' NE2' ' B' ' 44' ' ' GLN . . . -62.82 -27.54 69.39 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.684 -0.635 . . . . 1.0700000000000001 110.091 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -81.44 -23.0 37.77 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.525 -1.36 . . . . 0.89000000000000001 108.479 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 41.7 t -84.66 103.01 13.39 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.409 -0.807 . . . . 0.23000000000000001 109.176 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.45 -30.25 69.53 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.39 -0.818 . . . . 1.1699999999999999 110.044 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -68.73 -41.85 78.44 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.183 -0.948 . . . . 2.2799999999999998 110.721 -178.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 88.1 m -85.55 -22.83 27.93 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.098 -1.001 . . . . 0.40000000000000002 110.022 -179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . 0.556 ' NE2' ' O ' ' B' ' 38' ' ' ALA . 12.7 tt0 -78.44 -71.01 0.45 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.982 -1.074 . . . . 1.53 108.904 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.84 104.6 9.58 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 105.705 -1.961 . . . . 1.3600000000000001 105.705 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 36.5 tttt -107.95 8.27 28.35 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 115.315 -0.857 . . . . 3.6600000000000001 111.276 -175.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.712 0 O-C-N 120.33 -1.481 . . . . 2.8999999999999999 109.535 -179.687 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.487 ' O ' HD12 ' A' ' 5' ' ' ILE . 67.6 m-85 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.474 0.654 . . . . 0.37 109.778 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 24.7 mt -72.26 -33.47 67.51 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.48 -0.762 . . . . 0.35999999999999999 110.519 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.91 -60.05 4.0 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.062 -1.024 . . . . 2.3100000000000001 110.447 -178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -60.04 -43.72 97.95 Favored Glycine 0 N--CA 1.494 2.509 0 C-N-CA 119.911 -1.138 . . . . 0.32000000000000001 110.343 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.487 HD12 ' O ' ' A' ' 1' ' ' PHE . 84.5 mt -60.15 -39.91 81.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 O-C-N 121.3 -1.118 . . . . 0.34999999999999998 110.466 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.99 -46.02 71.61 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.953 -1.092 . . . . 1.8700000000000001 108.167 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.7 mttp -68.71 -51.28 43.24 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.233 -0.917 . . . . 2.3900000000000001 109.257 178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.58 -34.13 73.74 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 109.231 -0.655 . . . . 0.20999999999999999 109.231 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -59.83 -42.72 94.17 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.124 -1.031 . . . . 1.3999999999999999 109.274 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -62.03 -41.27 97.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.104 -0.998 . . . . 1.76 109.151 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.41 ' OE2' ' CE2' ' A' ' 15' ' ' TYR . 54.9 tp10 -61.24 -40.12 92.86 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.222 -1.029 . . . . 2.5 108.222 179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.559 ' O ' ' N ' ' A' ' 16' ' ' HIS . 16.6 t60 -60.35 -48.73 80.5 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.18 -0.95 . . . . 0.19 109.706 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 76.5 tt0 -60.21 -40.5 90.37 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.122 -0.986 . . . . 1.8500000000000001 110.494 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mtpt -61.46 -39.88 92.49 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.328 -0.857 . . . . 1.5600000000000001 112.044 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.41 ' CE2' ' OE2' ' A' ' 11' ' ' GLU . 6.6 m-85 -131.55 -0.68 3.93 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.958 -1.089 . . . . 0.40000000000000002 112.682 -177.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.559 ' N ' ' O ' ' A' ' 12' ' ' HIS . 89.5 m-70 51.58 40.65 27.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.473 -1.392 . . . . 0.26000000000000001 107.429 -177.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 77.6 p -62.45 156.18 23.47 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.471 0.653 . . . . 0.20000000000000001 110.204 -178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -73.5 160.03 32.32 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.505 -0.747 . . . . 1.1100000000000001 109.384 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -57.75 -27.54 63.11 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.227 -0.921 . . . . 0.34999999999999998 110.763 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.5 mtt180 -64.46 -45.06 89.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.824 -1.172 . . . . 2.9199999999999999 109.756 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.34 -46.8 81.92 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.499 -0.751 . . . . 0.27000000000000002 109.2 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 76.8 mtm -61.93 -41.28 97.76 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.462 -0.895 . . . . 0.53000000000000003 109.258 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.473 ' O ' ' N ' ' A' ' 27' ' ' ASN . . . -59.92 -44.23 94.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.474 -0.766 . . . . 0.26000000000000001 109.495 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.68 -36.89 70.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.419 -0.801 . . . . 1.1599999999999999 109.789 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -60.02 -46.89 88.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.174 -0.954 . . . . 1.8899999999999999 109.658 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -106.11 3.73 28.37 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.409 -0.807 . . . . 0.28000000000000003 110.608 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.473 ' N ' ' O ' ' A' ' 23' ' ' ALA . 18.2 m-20 54.4 45.39 27.23 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.006 -1.059 . . . . 2.0499999999999998 109.99 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.2 mt -109.88 149.99 40.74 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 120.839 -1.163 . . . . 0.31 108.595 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -59.05 152.03 61.91 Favored 'Trans proline' 0 N--CA 1.489 1.237 0 C-N-CA 121.437 1.424 . . . . 0.37 111.4 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -45.21 -33.86 8.98 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 C-N-CA 122.373 2.049 . . . . 0.48999999999999999 112.55 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG11 HD11 ' B' ' 5' ' ' ILE . 84.3 t -57.76 -49.97 79.1 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 O-C-N 121.436 -0.79 . . . . 0.29999999999999999 110.226 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.487 HG13 HD11 ' A' ' 5' ' ' ILE . 60.7 t -65.57 -48.72 81.69 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.99 0 C-N-CA 118.326 -1.349 . . . . 0.17999999999999999 109.131 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.42 -43.12 91.54 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.217 -0.927 . . . . 0.17000000000000001 110.192 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -65.82 -34.29 77.81 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.792 -1.192 . . . . 1.77 110.341 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.496 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -60.07 -40.01 88.03 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.809 -1.182 . . . . 1.1200000000000001 109.094 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.1 mt -60.06 -40.03 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 120.622 -1.299 . . . . 0.19 109.419 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.8 t -61.79 -40.01 85.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 N-CA-C 108.042 -1.095 . . . . 0.23000000000000001 108.042 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.411 ' O ' ' OE1' ' A' ' 44' ' ' GLN . . . -62.84 -27.44 69.33 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.688 -0.633 . . . . 0.27000000000000002 110.157 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -81.48 -23.05 37.65 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.563 -1.336 . . . . 0.29999999999999999 108.471 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.7 t -84.61 103.0 13.35 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.377 -0.827 . . . . 0.23000000000000001 109.163 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.43 -30.25 69.52 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.425 -0.797 . . . . 1.1699999999999999 110.067 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -68.79 -41.83 78.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.181 -0.949 . . . . 1.73 110.665 -178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 87.1 m -85.58 -22.77 27.91 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.049 -1.032 . . . . 0.40000000000000002 110.031 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.411 ' OE1' ' O ' ' A' ' 38' ' ' ALA . 41.2 tt0 -78.45 -70.87 0.46 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.981 -1.074 . . . . 1.1699999999999999 108.96 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 mt -78.9 103.3 8.75 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 105.923 -1.88 . . . . 1.01 105.923 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 36.2 tttt -106.89 8.17 30.49 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 115.323 -0.853 . . . . 3.3199999999999998 111.423 -175.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.711 0 O-C-N 120.269 -1.519 . . . . 2.3300000000000001 109.533 -179.724 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' PHE . . . . . 0.479 ' O ' HD12 ' B' ' 5' ' ' ILE . 67.7 m-85 . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.465 0.65 . . . . 0.35999999999999999 109.806 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 24.8 mt -72.28 -33.47 67.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.477 -0.764 . . . . 0.35999999999999999 110.51 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.92 -60.06 3.98 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.994 -1.066 . . . . 2.3300000000000001 110.416 -178.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -59.99 -43.84 97.78 Favored Glycine 0 N--CA 1.493 2.45 0 C-N-CA 119.925 -1.131 . . . . 0.32000000000000001 110.382 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.479 HD11 HG13 ' B' ' 32' ' ' VAL . 84.6 mt -60.0 -40.01 81.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 O-C-N 121.331 -1.1 . . . . 0.34000000000000002 110.46 -179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.99 -46.01 71.59 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.969 -1.082 . . . . 1.8700000000000001 108.209 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 29.7 mttp -68.71 -51.28 43.29 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.292 -0.88 . . . . 2.4100000000000001 109.285 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.11 73.58 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 109.301 -0.629 . . . . 0.20000000000000001 109.301 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -60.02 -42.58 94.64 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 119.045 -1.062 . . . . 1.3999999999999999 109.252 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -62.02 -41.28 97.92 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.11 -0.994 . . . . 1.78 109.175 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.413 ' OE2' ' CE2' ' B' ' 15' ' ' TYR . 54.9 tp10 -61.3 -40.07 92.78 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.205 -1.035 . . . . 2.5099999999999998 108.205 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' HIS . . . . . 0.587 ' O ' ' N ' ' B' ' 16' ' ' HIS . 16.5 t60 -60.27 -49.06 79.12 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.236 -0.915 . . . . 0.19 109.612 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -59.97 -40.58 89.54 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.102 -0.999 . . . . 1.8500000000000001 110.49 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mtpt -61.34 -39.96 92.5 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.277 -0.889 . . . . 1.5900000000000001 112.074 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' TYR . . . . . 0.413 ' CE2' ' OE2' ' B' ' 11' ' ' GLU . 6.6 m-85 -131.53 -0.73 3.94 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.914 -1.116 . . . . 0.35999999999999999 112.67 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' HIS . . . . . 0.587 ' N ' ' O ' ' B' ' 12' ' ' HIS . 89.4 m-70 51.55 40.68 27.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.435 -1.416 . . . . 0.26000000000000001 107.471 -177.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 77.7 p -62.49 156.16 23.66 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.487 0.661 . . . . 0.20000000000000001 110.22 -178.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -73.51 160.03 32.3 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.523 -0.736 . . . . 1.1100000000000001 109.417 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 46.1 p-90 -57.79 -27.46 63.12 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.33000000000000002 110.701 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 26.4 mtt180 -64.47 -45.09 88.89 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.784 -1.198 . . . . 2.9500000000000002 109.754 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.35 -46.82 81.78 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.514 -0.741 . . . . 0.26000000000000001 109.198 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 76.8 mtm -61.88 -41.3 97.7 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.527 -0.869 . . . . 0.52000000000000002 109.308 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' B' ' 27' ' ' ASN . . . -59.91 -44.3 94.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.486 -0.759 . . . . 0.25 109.462 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.6 -36.97 71.0 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.356 -0.84 . . . . 1.21 109.804 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -59.98 -46.95 87.79 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.132 -0.98 . . . . 1.8700000000000001 109.598 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -106.04 3.72 28.5 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.508 -0.745 . . . . 0.28000000000000003 110.668 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' B' ' 23' ' ' ALA . 18.4 m-20 54.5 45.29 27.31 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.011 -1.056 . . . . 2.0499999999999998 110.045 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 88.2 mt -109.85 150.02 40.78 Favored Pre-proline 0 N--CA 1.501 2.12 0 O-C-N 120.811 -1.181 . . . . 0.29999999999999999 108.62 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -59.15 152.04 62.37 Favored 'Trans proline' 0 N--CA 1.489 1.23 0 C-N-CA 121.45 1.433 . . . . 0.37 111.368 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -45.18 -33.9 8.94 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 C-N-CA 122.403 2.069 . . . . 0.53000000000000003 112.532 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.424 HG11 HD11 ' A' ' 5' ' ' ILE . 83.9 t -57.7 -50.08 78.66 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 O-C-N 121.377 -0.827 . . . . 0.29999999999999999 110.174 -178.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' VAL . . . . . 0.479 HG13 HD11 ' B' ' 5' ' ' ILE . 60.6 t -65.51 -48.8 81.53 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.998 0 C-N-CA 118.302 -1.359 . . . . 0.17000000000000001 109.144 -179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.29 -43.2 91.9 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.213 -0.93 . . . . 0.16 110.207 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 16.4 mtpt -65.85 -34.06 77.29 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.794 -1.192 . . . . 1.74 110.399 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.481 ' OE2' ' O ' ' B' ' 35' ' ' GLU . 0.6 OUTLIER -60.29 -40.03 89.0 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.866 -1.146 . . . . 1.1200000000000001 109.054 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 73.9 mt -59.99 -40.04 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 120.642 -1.287 . . . . 0.17999999999999999 109.453 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 72.5 t -61.8 -39.94 85.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 108.103 -1.073 . . . . 0.22 108.103 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' ALA . . . . . 0.556 ' O ' ' NE2' ' B' ' 44' ' ' GLN . . . -62.82 -27.54 69.39 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.684 -0.635 . . . . 0.27000000000000002 110.091 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -81.44 -23.0 37.77 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.525 -1.36 . . . . 0.28999999999999998 108.479 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 41.7 t -84.66 103.01 13.39 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.409 -0.807 . . . . 0.23000000000000001 109.176 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.45 -30.25 69.53 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.39 -0.818 . . . . 1.1699999999999999 110.044 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -68.73 -41.85 78.44 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.183 -0.948 . . . . 1.74 110.721 -178.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 88.1 m -85.55 -22.83 27.93 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.098 -1.001 . . . . 0.40000000000000002 110.022 -179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' GLN . . . . . 0.556 ' NE2' ' O ' ' B' ' 38' ' ' ALA . 12.7 tt0 -78.44 -71.01 0.45 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.982 -1.074 . . . . 1.1399999999999999 108.904 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.84 104.6 9.58 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 105.705 -1.961 . . . . 1.0 105.705 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 36.5 tttt -107.95 8.27 28.35 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 115.315 -0.857 . . . . 3.2999999999999998 111.276 -175.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.712 0 O-C-N 120.33 -1.481 . . . . 2.3199999999999998 109.535 -179.687 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.487 ' O ' HD12 ' A' ' 5' ' ' ILE . 67.6 m-85 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.474 0.654 . . . . 0.37 109.778 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 24.7 mt -72.26 -33.47 67.51 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.48 -0.762 . . . . 0.35999999999999999 110.519 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.91 -60.05 4.0 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.062 -1.024 . . . . 2.3100000000000001 110.447 -178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -60.04 -43.72 97.95 Favored Glycine 0 N--CA 1.494 2.509 0 C-N-CA 119.911 -1.138 . . . . 0.32000000000000001 110.343 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.487 HD12 ' O ' ' A' ' 1' ' ' PHE . 84.5 mt -60.15 -39.91 81.94 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.551 0 O-C-N 121.3 -1.118 . . . . 0.34999999999999998 110.466 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.99 -46.02 71.61 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 120.953 -1.092 . . . . 1.8700000000000001 108.167 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.7 mttp -68.71 -51.28 43.24 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.233 -0.917 . . . . 2.3900000000000001 109.257 178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.58 -34.13 73.74 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 109.231 -0.655 . . . . 0.20999999999999999 109.231 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -59.83 -42.72 94.17 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.124 -1.031 . . . . 1.3999999999999999 109.274 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -62.03 -41.27 97.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.104 -0.998 . . . . 1.76 109.151 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.41 ' OE2' ' CE2' ' A' ' 15' ' ' TYR . 54.9 tp10 -61.24 -40.12 92.86 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.222 -1.029 . . . . 2.5 108.222 179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.559 ' O ' ' N ' ' A' ' 16' ' ' HIS . 16.6 t60 -60.35 -48.73 80.5 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.18 -0.95 . . . . 0.19 109.706 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 76.5 tt0 -60.21 -40.5 90.37 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.122 -0.986 . . . . 1.8500000000000001 110.494 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mtpt -61.46 -39.88 92.49 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.328 -0.857 . . . . 1.5600000000000001 112.044 -178.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.41 ' CE2' ' OE2' ' A' ' 11' ' ' GLU . 6.6 m-85 -131.55 -0.68 3.93 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 120.958 -1.089 . . . . 0.40000000000000002 112.682 -177.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.559 ' N ' ' O ' ' A' ' 12' ' ' HIS . 89.5 m-70 51.58 40.65 27.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.473 -1.392 . . . . 0.26000000000000001 107.429 -177.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 77.6 p -62.45 156.18 23.47 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-O 121.471 0.653 . . . . 0.20000000000000001 110.204 -178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -73.5 160.03 32.32 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.505 -0.747 . . . . 1.1100000000000001 109.384 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 45.9 p-90 -57.75 -27.54 63.11 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.227 -0.921 . . . . 0.34999999999999998 110.763 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.5 mtt180 -64.46 -45.06 89.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.824 -1.172 . . . . 2.9199999999999999 109.756 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.34 -46.8 81.92 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.499 -0.751 . . . . 0.27000000000000002 109.2 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 76.8 mtm -61.93 -41.28 97.76 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.462 -0.895 . . . . 0.53000000000000003 109.258 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.473 ' O ' ' N ' ' A' ' 27' ' ' ASN . . . -59.92 -44.23 94.43 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.474 -0.766 . . . . 0.26000000000000001 109.495 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.68 -36.89 70.76 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.419 -0.801 . . . . 1.1599999999999999 109.789 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -60.02 -46.89 88.02 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.174 -0.954 . . . . 1.8899999999999999 109.658 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -106.11 3.73 28.37 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.409 -0.807 . . . . 0.28000000000000003 110.608 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.473 ' N ' ' O ' ' A' ' 23' ' ' ALA . 18.2 m-20 54.4 45.39 27.23 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.006 -1.059 . . . . 2.0499999999999998 109.99 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 88.2 mt -109.88 149.99 40.74 Favored Pre-proline 0 N--CA 1.501 2.105 0 O-C-N 120.839 -1.163 . . . . 0.31 108.595 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -59.05 152.03 61.91 Favored 'Trans proline' 0 N--CA 1.489 1.237 0 C-N-CA 121.437 1.424 . . . . 0.37 111.4 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -45.21 -33.86 8.98 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 C-N-CA 122.373 2.049 . . . . 0.48999999999999999 112.55 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG11 HD11 ' B' ' 5' ' ' ILE . 84.3 t -57.76 -49.97 79.1 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 O-C-N 121.436 -0.79 . . . . 0.29999999999999999 110.226 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.487 HG13 HD11 ' A' ' 5' ' ' ILE . 60.7 t -65.57 -48.72 81.69 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.99 0 C-N-CA 118.326 -1.349 . . . . 0.17999999999999999 109.131 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.42 -43.12 91.54 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.217 -0.927 . . . . 0.17000000000000001 110.192 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -65.82 -34.29 77.81 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.792 -1.192 . . . . 1.77 110.341 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.496 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -60.07 -40.01 88.03 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.809 -1.182 . . . . 1.1200000000000001 109.094 -179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.1 mt -60.06 -40.03 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 120.622 -1.299 . . . . 0.19 109.419 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.8 t -61.79 -40.01 85.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 N-CA-C 108.042 -1.095 . . . . 0.23000000000000001 108.042 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.411 ' O ' ' OE1' ' A' ' 44' ' ' GLN . . . -62.84 -27.44 69.33 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.688 -0.633 . . . . 0.27000000000000002 110.157 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -81.48 -23.05 37.65 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.563 -1.336 . . . . 0.29999999999999999 108.471 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.7 t -84.61 103.0 13.35 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.377 -0.827 . . . . 0.23000000000000001 109.163 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.43 -30.25 69.52 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.425 -0.797 . . . . 1.1699999999999999 110.067 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -68.79 -41.83 78.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.181 -0.949 . . . . 1.73 110.665 -178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 87.1 m -85.58 -22.77 27.91 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.049 -1.032 . . . . 0.40000000000000002 110.031 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.411 ' OE1' ' O ' ' A' ' 38' ' ' ALA . 41.2 tt0 -78.45 -70.87 0.46 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.981 -1.074 . . . . 1.1699999999999999 108.96 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 16.7 mt -78.9 103.3 8.75 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 105.923 -1.88 . . . . 1.01 105.923 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 36.2 tttt -106.89 8.17 30.49 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 115.323 -0.853 . . . . 3.3199999999999998 111.423 -175.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.711 0 O-C-N 120.269 -1.519 . . . . 2.3300000000000001 109.533 -179.724 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . 0.479 ' O ' HD12 ' B' ' 5' ' ' ILE . 67.7 m-85 . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.465 0.65 . . . . 0.35999999999999999 109.806 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 24.8 mt -72.28 -33.47 67.46 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.477 -0.764 . . . . 0.35999999999999999 110.51 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.92 -60.06 3.98 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.994 -1.066 . . . . 2.3300000000000001 110.416 -178.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -59.99 -43.84 97.78 Favored Glycine 0 N--CA 1.493 2.45 0 C-N-CA 119.925 -1.131 . . . . 0.32000000000000001 110.382 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.479 HD11 HG13 ' B' ' 32' ' ' VAL . 84.6 mt -60.0 -40.01 81.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.607 0 O-C-N 121.331 -1.1 . . . . 0.34000000000000002 110.46 -179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -53.99 -46.01 71.59 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.969 -1.082 . . . . 1.8700000000000001 108.209 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 29.7 mttp -68.71 -51.28 43.29 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.292 -0.88 . . . . 2.4100000000000001 109.285 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.49 -34.11 73.58 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 109.301 -0.629 . . . . 0.20000000000000001 109.301 -178.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' GLN . . . . . . . . . . . . . 54.6 tt0 -60.02 -42.58 94.64 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 119.045 -1.062 . . . . 1.3999999999999999 109.252 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -62.02 -41.28 97.92 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.11 -0.994 . . . . 1.78 109.175 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.413 ' OE2' ' CE2' ' B' ' 15' ' ' TYR . 54.9 tp10 -61.3 -40.07 92.78 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.205 -1.035 . . . . 2.5099999999999998 108.205 179.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . 0.587 ' O ' ' N ' ' B' ' 16' ' ' HIS . 16.5 t60 -60.27 -49.06 79.12 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.236 -0.915 . . . . 0.19 109.612 179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -59.97 -40.58 89.54 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.102 -0.999 . . . . 1.8500000000000001 110.49 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mtpt -61.34 -39.96 92.5 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.277 -0.889 . . . . 1.5900000000000001 112.074 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' TYR . . . . . 0.413 ' CE2' ' OE2' ' B' ' 11' ' ' GLU . 6.6 m-85 -131.53 -0.73 3.94 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.914 -1.116 . . . . 0.35999999999999999 112.67 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . 0.587 ' N ' ' O ' ' B' ' 12' ' ' HIS . 89.4 m-70 51.55 40.68 27.55 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.435 -1.416 . . . . 0.26000000000000001 107.471 -177.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 77.7 p -62.49 156.16 23.66 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.487 0.661 . . . . 0.20000000000000001 110.22 -178.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -73.51 160.03 32.3 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.523 -0.736 . . . . 1.1100000000000001 109.417 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' TRP . . . . . . . . . . . . . 46.1 p-90 -57.79 -27.46 63.12 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.936 . . . . 0.33000000000000002 110.701 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 26.4 mtt180 -64.47 -45.09 88.89 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.784 -1.198 . . . . 2.9500000000000002 109.754 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.35 -46.82 81.78 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.514 -0.741 . . . . 0.26000000000000001 109.198 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 76.8 mtm -61.88 -41.3 97.7 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.527 -0.869 . . . . 0.52000000000000002 109.308 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.468 ' O ' ' N ' ' B' ' 27' ' ' ASN . . . -59.91 -44.3 94.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.486 -0.759 . . . . 0.25 109.462 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.6 -36.97 71.0 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.356 -0.84 . . . . 1.21 109.804 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -59.98 -46.95 87.79 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.132 -0.98 . . . . 1.8700000000000001 109.598 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -106.04 3.72 28.5 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.508 -0.745 . . . . 0.28000000000000003 110.668 -178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' B' ' 23' ' ' ALA . 18.4 m-20 54.5 45.29 27.31 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.011 -1.056 . . . . 2.0499999999999998 110.045 179.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 88.2 mt -109.85 150.02 40.78 Favored Pre-proline 0 N--CA 1.501 2.12 0 O-C-N 120.811 -1.181 . . . . 0.29999999999999999 108.62 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -59.15 152.04 62.37 Favored 'Trans proline' 0 N--CA 1.489 1.23 0 C-N-CA 121.45 1.433 . . . . 0.37 111.368 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -45.18 -33.9 8.94 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 C-N-CA 122.403 2.069 . . . . 0.53000000000000003 112.532 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.424 HG11 HD11 ' A' ' 5' ' ' ILE . 83.9 t -57.7 -50.08 78.66 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.62 0 O-C-N 121.377 -0.827 . . . . 0.29999999999999999 110.174 -178.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.479 HG13 HD11 ' B' ' 5' ' ' ILE . 60.6 t -65.51 -48.8 81.53 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.998 0 C-N-CA 118.302 -1.359 . . . . 0.17000000000000001 109.144 -179.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.29 -43.2 91.9 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.213 -0.93 . . . . 0.16 110.207 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 16.4 mtpt -65.85 -34.06 77.29 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 120.794 -1.192 . . . . 1.74 110.399 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.481 ' OE2' ' O ' ' B' ' 35' ' ' GLU . 0.6 OUTLIER -60.29 -40.03 89.0 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.866 -1.146 . . . . 1.1200000000000001 109.054 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 73.9 mt -59.99 -40.04 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 120.642 -1.287 . . . . 0.17999999999999999 109.453 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 72.5 t -61.8 -39.94 85.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 108.103 -1.073 . . . . 0.22 108.103 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' ALA . . . . . 0.556 ' O ' ' NE2' ' B' ' 44' ' ' GLN . . . -62.82 -27.54 69.39 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.684 -0.635 . . . . 0.27000000000000002 110.091 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -81.44 -23.0 37.77 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.525 -1.36 . . . . 0.28999999999999998 108.479 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 41.7 t -84.66 103.01 13.39 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.409 -0.807 . . . . 0.23000000000000001 109.176 179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -60.45 -30.25 69.53 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.39 -0.818 . . . . 1.1699999999999999 110.044 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -68.73 -41.85 78.44 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.183 -0.948 . . . . 1.74 110.721 -178.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 88.1 m -85.55 -22.83 27.93 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.098 -1.001 . . . . 0.40000000000000002 110.022 -179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . 0.556 ' NE2' ' O ' ' B' ' 38' ' ' ALA . 12.7 tt0 -78.44 -71.01 0.45 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.982 -1.074 . . . . 1.1399999999999999 108.904 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 16.5 mt -78.84 104.6 9.58 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 105.705 -1.961 . . . . 1.0 105.705 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 36.5 tttt -107.95 8.27 28.35 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 115.315 -0.857 . . . . 3.2999999999999998 111.276 -175.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.712 0 O-C-N 120.33 -1.481 . . . . 2.3199999999999998 109.535 -179.687 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_